0 B9R1.83 BrCCCCOC1CC1 34a_100011216708_100000211595 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.83 BrCCCOCC1CC1 34a_100011217188_100000742324 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.83 BrCCOCCC1CC1 34a_100000211926_100000694398 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.83 BrCCOCCC1CO1 34a_100000211926_100000732470 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.83 C#CCNCCC1CC1 34a_100000212058_100000694398 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.83 C#CCNCCC1CC1 34a_100000764129_100000184674 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.83 C#CCNCCC1CO1 34a_100000212058_100000732470 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.83 C#CCOCCC1CC1 34a_100000210247_100000694398 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.83 C#CCOCCC1CC1 34a_100000754188_100000184674 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.83 C#CCOCCC1CC1 7a_100000754188_100000038162 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.83 C#CCSCCC1CC1 62a_100000038162_100000764125 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.83 C=CCNCCC1CC1 2230a_100020586998_100000694398 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.83 C=CCNCCC1CC1 34a_100000764129_100015514636 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.83 C=CCNCCC1CO1 2230a_100020586998_100000732470 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.83 C=CCOCCC1CC1 34a_100000754188_100015514636 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.83 C=CCOCCC1CC1 34a_200000210373_100000694398 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.83 C=CCOCCC1CC1 7a_100000754188_100015514636 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.83 C=CCSCCC1CC1 62a_100000210623_100000764125 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.83 C=CCSCCC1CC1 62a_100000764125_100000210623 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.83 CCCCCNC1CC1 34a_100000212008_100000718602 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.83 CCCCCOC1CC1 34a_100000210253_100000211595 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.83 CCCCCSC1CC1 62a_100000210326_100000211595 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.83 CCCCNCC1CC1 2230a_100000102301_100000742324 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.83 CCCCNCC1CC1 2230a_100000735609_100000210211 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.83 CCCCNCC1CC1 269862a_100000102301_100000741477 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.83 CCCCNCC1CC1 34a_100000735609_100000210210 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.83 CCCCNCC1CC1 7a_106832991798_100000742324 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.83 CCCCOCC1CC1 34a_100000210227_100000742324 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.83 CCCCOCC1CC1 34a_100000211283_100000210210 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.83 CCCCOCC1CC1 7a_100000210227_100000742324 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.83 CCCCSCC1CC1 62a_100000210211_100000742324 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.83 CCCCSCC1CC1 62a_100000756562_100000210210 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.83 CCCNCCC1CC1 34a_100000764129_100000210303 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.83 CCCNN=CC1CC1 4a_100000740057_100000741477 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.83 CCCOCCC1CC1 34a_100000210258_100000694398 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.83 CCCOCCC1CC1 34a_100000754188_100000210303 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.83 CCCOCCC1CC1 7a_100000754188_100000210303 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.83 CCCOCCC1CO1 34a_100000210258_100000732470 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.83 CCCOCC[C@@H]1CO1 34a_100009820653_100000210303 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.83 CCCSCCC1CC1 62a_100000210303_100000764125 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.83 CCCSCCC1CC1 62a_100000764125_100000210303 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.83 CCCSCCC1CO1 62a_100000210303_100000732470 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.83 CCCSCCC1CO1 62a_100000732470_100000210303 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.83 COCSCCC1CC1 62a_100000764125_100000766300 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.83 COCSCCC1CC1 62a_100000766300_100000764125 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.83 CSCNCCC1CC1 34a_100000764129_100011218213 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.83 CSCOCCC1CC1 34a_100000754188_100011218213 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.83 CSCSCCC1CC1 62a_100000764125_100011218213 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.83 CSCSCCC1CC1 62a_100011218213_100000764125 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.83 ClCCCCOC1CC1 34a_100000210776_100000211595 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.83 ClCCCOCC1CC1 34a_100000230001_100000742324 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.83 FCCCCNC1CC1 34a_100000212008_100000729493 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.83 FCCCCOC1CC1 34a_100011995726_100000211595 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.83 FCCCCSC1CC1 62a_100000729493_100000211595 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.83 FCCCNCC1CC1 2230a_100000735609_100011934791 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.83 FCCCNCC1CC1 2230a_100015189416_100000742324 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.83 FCCCNCC1CC1 269862a_100015189416_100000741477 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.83 FCCCNCC1CC1 34a_100000735609_100011934791 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.83 FCCCNCC1CC1 34a_100015189416_100000742324 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.83 FCCCOCC1CC1 34a_100000211283_100011934791 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.83 FCCCOCC1CC1 34a_100000759539_100000742324 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.83 FCCCSCC1CC1 62a_100000756562_100011934791 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.83 FCCCSCC1CC1 62a_100011934791_100000742324 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.83 FCCNCCC1CC1 34a_100000724931_100000694398 [0,0,0,0,0,0|2,0,0]=2 64 B9R1.83 FCCNCCC1CC1 34a_100000764129_100011217306 [0,0,0,0,0,0|2,0,0]=2 65 B9R1.83 FCCNCCC1CO1 34a_100000724931_100000732470 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.83 FCCOCCC1CC1 34a_100000754188_100011217306 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.83 FCCOCCC1CC1 7a_100000754188_100011217306 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.83 FCCOCC[C@@H]1CO1 34a_100009820653_100011217306 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.83 FCCSCCC1CC1 62a_100000764125_100011217306 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.83 FCCSCCC1CC1 62a_100011217306_100000764125 [0,0,0,0,0,0|3,0,0]=3 71 B9R1.83 FCCSCCC1CO1 62a_100000732470_100011217306 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.83 FCCSCCC1CO1 62a_100011217306_100000732470 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.83 ICCCCOC1CC1 34a_200012148704_100000211595 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.83 N#CCOCCC1CC1 7a_100000754188_100011215382 [0,0,0,0,0,0|2,0,2]=4 75 B9R1.83 N#CCSCCC1CC1 62a_100000764125_100011215382 [0,0,0,0,0,0|2,0,2]=4 76 B9R1.83 N#CCSCCC1CC1 62a_100011215382_100000764125 [0,0,0,0,0,0|2,0,2]=4 77 B9R1.83 NCCCCOC1CC1 34a_100000750430_100000211595 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.83 NCCCOCC1CC1 34a_100000182051_100000742324 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.83 NCCCOCC1CO1 34a_100000182051_102125554688 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.83 NCCOCCC1CC1 34a_100000210304_100000694398 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.83 NCCOCCC1CO1 34a_100000210304_100000732470 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.83 NOCCOCC1CC1 34a_100000700252_100000742324 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.83 O=CCNCCC1CC1 34a_100000764129_200009817547 [0,0,0,0,0,0|2,0,1]=3 84 B9R1.83 O=CCOCCC1CC1 34a_100000754188_200009817547 [0,0,0,0,0,0|3,0,1]=4 85 B9R1.83 O=CCOCCC1CC1 7a_100000754188_200015260668 [0,0,0,0,0,0|3,0,1]=4 86 B9R1.83 O=CCSCCC1CC1 62a_100000764125_200015260668 [0,0,0,0,0,0|3,0,1]=4 87 B9R1.83 O=CCSCCC1CC1 62a_200015260668_100000764125 [0,0,0,0,0,0|3,0,1]=4 88 B9R1.83 OCCCCNC1CC1 34a_100000212008_100011216708 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.83 OCCCCNC1CC1 34a_100000750430_100000211595 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.83 OCCCCSC1CC1 62a_100000210776_100000211595 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.83 OCCCNCC1CC1 2230a_100000735609_100000230001 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.83 OCCCNCC1CC1 269862a_100000182051_100000741477 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.83 OCCCNCC1CC1 34a_100000735609_100000230001 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.83 OCCCOCC1CC1 34a_100000211283_100000230001 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.83 OCCCSCC1CC1 62a_100000756562_100011215043 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.83 OCCCSCC1CC1 62a_100011215043_100000742324 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.83 OCCNCCC1CC1 2230a_100016997473_100000694398 [0,0,0,0,0,0|2,0,0]=2 98 B9R1.83 OCCNCCC1CC1 34a_100000764129_100000211926 [0,0,0,0,0,0|2,0,0]=2 99 B9R1.83 OCCNCCC1CC1 34a_100016990907_100000694398 [0,0,0,0,0,0|2,0,0]=2 100 B9R1.83 OCCNCCC1CO1 2230a_100016997473_100000732470 [0,0,0,0,0,0|3,0,0]=3 101 B9R1.83 OCCNCCC1CO1 34a_100016990907_100000732470 [0,0,0,0,0,0|3,0,0]=3 102 B9R1.83 OCCNN=CC1CC1 4a_100000210001_100000741477 [0,0,0,0,0,0|3,0,1]=4 103 B9R1.83 OCCOCCC1CC1 34a_100000754188_100000211926 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.83 OCCOCCC1CC1 7a_100000754188_100000211926 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.83 OCCOCC[C@@H]1CO1 34a_100009820653_100000211926 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.83 OCCSCCC1CC1 62a_100000211926_100000764125 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.83 OCCSCCC1CC1 62a_100000764125_100000211926 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.83 OCCSCCC1CO1 62a_100000211926_100000732470 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.83 OCCSCCC1CO1 62a_100000732470_100000211926 [0,0,0,0,0,0|4,0,0]=4 110 B8R1.36 BrCCCOC1CC1 34a_100011217188_100000211595 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.36 BrCCOCC1CC1 34a_100000211926_100000742324 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.36 C#CCNCC1CC1 2230a_100000735609_100000038162 [1,0,0,0,0,0|2,0,1]=4 113 B8R1.36 C#CCNCC1CC1 34a_100000212058_100000742324 [1,0,0,0,0,0|2,0,1]=4 114 B8R1.36 C#CCNCC1CC1 34a_100000735609_100000184674 [1,0,0,0,0,0|2,0,1]=4 115 B8R1.36 C=CCNCC1CC1 2230a_100000735609_100000210623 [1,0,0,0,0,0|2,0,1]=4 116 B8R1.36 C=CCNCC1CC1 2230a_100020586998_100000742324 [1,0,0,0,0,0|2,0,1]=4 117 B8R1.36 C=CCNCC1CC1 34a_100000735609_100015514636 [1,0,0,0,0,0|2,0,1]=4 118 B8R1.36 CCCCNC1CC1 34a_100000212008_100000210210 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.36 CCCCOC1CC1 34a_100000210227_100000211595 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.36 CCCCSC1CC1 62a_100000210211_100000211595 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.36 CCCNCC1CC1 2230a_100000735609_100000210303 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.36 CCCNCC1CC1 269862a_100020643023_100000741477 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.36 CCCNCC1CC1 34a_100000735609_100000210303 [1,0,0,0,0,0|2,0,0]=3 124 B8R1.36 CCCOCC1CC1 34a_100000210258_100000742324 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.36 CCCOCC1CC1 34a_100000211283_100000210303 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.36 CCCSCC1CC1 62a_100000210303_100000742324 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.36 CCCSCC1CC1 62a_100000756562_100000210303 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.36 CCNCCC1CC1 2230a_100015525214_100000694398 [1,0,0,0,0,0|1,0,0]=2 129 B8R1.36 CCNCCC1CC1 34a_100000764129_100000210202 [1,0,0,0,0,0|1,0,0]=2 130 B8R1.36 CCNCCC1CO1 2230a_100015525214_100000732470 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.36 CCNN=CC1CC1 4a_100000756455_100000741477 [1,0,0,0,0,0|2,0,1]=4 132 B8R1.36 CCOCCC1CC1 34a_100000754188_100000210202 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.36 CCOCCC1CC1 34a_100121572206_100000694398 [1,0,0,0,0,0|2,0,0]=3 134 B8R1.36 CCOCCC1CC1 7a_100000754188_100000210202 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.36 CCOCCC1CO1 34a_100121572206_100000732470 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.36 CCOCC[C@@H]1CO1 34a_100009820653_100000210202 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.36 CCOCSC1CC1 62a_100000739092_100000211595 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.36 CCSCCC1CC1 62a_100000210202_100000764125 [1,0,0,0,0,0|2,0,0]=3 139 B8R1.36 CCSCCC1CC1 62a_100000764125_100000210202 [1,0,0,0,0,0|2,0,0]=3 140 B8R1.36 CCSCCC1CO1 62a_100000210202_100000732470 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.36 CCSCCC1CO1 62a_100000732470_100000210202 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.36 COCNCC1CC1 2230a_100000735609_100000766300 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.36 CSCNCC1CC1 2230a_100000735609_100011218213 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.36 CSCNCC1CC1 34a_100000735609_100011218213 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.36 ClCCCOC1CC1 34a_100000230001_100000211595 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.36 FCCCNC1CC1 34a_100000212008_100011934791 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.36 FCCCNC1CC1 34a_100015189416_100000211595 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.36 FCCCOC1CC1 34a_100000759539_100000211595 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.36 FCCCSC1CC1 62a_100011934791_100000211595 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.36 FCCNCC1CC1 2230a_100000735609_100011217306 [1,0,0,0,0,0|2,0,0]=3 151 B8R1.36 FCCNCC1CC1 269862a_100000724931_100000741477 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.36 FCCNCC1CC1 34a_100000724931_100000742324 [1,0,0,0,0,0|2,0,0]=3 153 B8R1.36 FCCNCC1CC1 34a_100000735609_100011217306 [1,0,0,0,0,0|2,0,0]=3 154 B8R1.36 FCCNCC1CO1 34a_100000724931_102125554688 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.36 FCCOCC1CC1 34a_100000211283_100011217306 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.36 FCCSCC1CC1 62a_100000756562_100011217306 [1,0,0,0,0,0|3,0,0]=4 157 B8R1.36 FCCSCC1CC1 62a_100011217306_100000742324 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.36 FCNCCC1CC1 34a_100000764129_100015361967 [1,0,0,0,0,0|2,0,0]=3 159 B8R1.36 FCOCCC1CC1 34a_100000754188_100015361967 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.36 FCOCCC1CC1 7a_100000754188_100015361967 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.36 FCSCCC1CC1 62a_100000764125_100015361967 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.36 FCSCCC1CC1 62a_100015361967_100000764125 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.36 N#CCNCC1CC1 2230a_100000735609_100011215382 [1,0,0,0,0,0|1,0,2]=4 164 B8R1.36 NCCCOC1CC1 34a_100000182051_100000211595 [1,0,0,0,0,0|2,0,0]=3 165 B8R1.36 NCCOCC1CC1 34a_100000210304_100000742324 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.36 NCCOCC1CO1 34a_100000210304_102125554688 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.36 NOCCOC1CC1 34a_100000700252_100000211595 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.36 O=CCNCC1CC1 2230a_100000735609_200015260668 [1,0,0,0,0,0|2,0,1]=4 169 B8R1.36 O=CCNCC1CC1 34a_100000735609_200009817547 [1,0,0,0,0,0|2,0,1]=4 170 B8R1.36 OCCCNC1CC1 34a_100000212008_100000230001 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.36 OCCCSC1CC1 62a_100011215043_100000211595 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.36 OCCNCC1CC1 2230a_100000735609_100000211926 [1,0,0,0,0,0|2,0,0]=3 173 B8R1.36 OCCNCC1CC1 2230a_100016997473_100000742324 [1,0,0,0,0,0|2,0,0]=3 174 B8R1.36 OCCNCC1CC1 269862a_100000210304_100000741477 [1,0,0,0,0,0|2,0,0]=3 175 B8R1.36 OCCNCC1CC1 34a_100000735609_100000211926 [1,0,0,0,0,0|2,0,0]=3 176 B8R1.36 OCCNCC1CC1 34a_100016990907_100000742324 [1,0,0,0,0,0|2,0,0]=3 177 B8R1.36 OCCNCC1CO1 2230a_100016997473_100011216344 [1,0,0,0,0,0|3,0,0]=4 178 B8R1.36 OCCNCC1CO1 34a_100016990907_102125554688 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.36 OCCOCC1CC1 34a_100000211283_100000211926 [1,0,0,0,0,0|3,0,0]=4 180 B8R1.36 OCCSCC1CC1 62a_100000211926_100000742324 [1,0,0,0,0,0|3,0,0]=4 181 B8R1.36 OCCSCC1CC1 62a_100000756562_100000211926 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.126 C=C(C)CNCCC1CC1 34a_100000764129_100000748629 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.126 C=C(F)CNCCC1CC1 34a_100000764129_100009893438 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.126 CC(Br)COCCC1CC1 34a_100012180447_100000694398 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.126 CC(C)CNCCC1CC1 2230a_100000210953_100000694398 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.126 CC(C)CNCCC1CC1 270004a_100000764129_100000210432 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.126 CC(C)CNCCC1CC1 34a_100000210953_100000694398 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.126 CC(C)CNCCC1CC1 34a_100000764129_100000210624 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.126 CC(C)CNCCC1CO1 2230a_100000210953_100000732470 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.126 CC(C)CNCCC1CO1 34a_100000210953_100000732470 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.126 CC(C)COCCC1CC1 34a_100000210257_100000694398 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.126 CC(C)COCCC1CC1 34a_100000754188_100000210624 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.126 CC(C)COCCC1CC1 7a_100000754188_100000210760 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.126 CC(C)CSCCC1CC1 62a_100000210624_100000764125 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.126 CC(C)CSCCC1CC1 62a_100000764125_100000210760 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.126 CC(F)COCCC1CC1 34a_100015925927_100000694398 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.126 CC(O)CNCCC1CC1 2230a_100000210904_100000694398 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.126 CC(O)CNCCC1CC1 34a_100000210904_100000694398 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.126 CC(O)CNCCC1CC1 34a_100000764129_100011218427 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.126 CC(O)CNCCC1CO1 2230a_100000210904_100000732470 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.126 CC(O)CNCCC1CO1 34a_100000210904_100000732470 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.126 CC(O)COCCC1CC1 34a_100000754188_100011218427 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.126 CC(O)COCCC1CC1 7a_100000754188_100011218427 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.126 CC(O)CSCCC1CC1 62a_100000764125_100011218427 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.126 CC(O)CSCCC1CC1 62a_100011218427_100000764125 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.126 C[C@@H](Cl)COCCC1CC1 34a_100016084084_100000694398 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.126 C[C@@H](N)CCOCC1CC1 34a_100000706166_100000742324 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.126 C[C@@H](N)COCCC1CC1 34a_100000737577_100000694398 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.126 C[C@@H](N)COCCC1CO1 34a_100000737577_100000732470 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.126 C[C@@H](O)CNCCC1CC1 34a_100000764129_100009817552 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.126 C[C@@H](O)COCCC1CC1 34a_100000754188_100009817552 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.126 C[C@@H](O)COCCC1CC1 7a_100000754188_100009817552 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.126 C[C@@H](O)CSCCC1CC1 62a_100000764125_100009817552 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.126 C[C@@H](O)CSCCC1CC1 62a_100009817552_100000764125 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.126 FC(F)CNCCC1CC1 34a_100000764129_100011934356 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.126 FC(F)CNCCC1CC1 34a_100000765723_100000694398 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.126 FC(F)CNCCC1CO1 34a_100000765723_100000732470 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.126 FC(F)COCCC1CC1 34a_100000743014_100000694398 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.126 FC(F)COCCC1CC1 34a_100000754188_100011934356 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.126 FC(F)COCCC1CC1 7a_100000754188_100011934356 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.126 FC(F)CSCCC1CC1 62a_100000764125_100011934356 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.126 FC(F)CSCCC1CC1 62a_100011934356_100000764125 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.126 NC(=O)CNCCC1CC1 2230a_100000711301_100000694398 [0,1,0,0,0,0|1,0,1]=3 224 B10R1.126 NC(=O)CNCCC1CC1 34a_100000764129_100000187820 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.126 NC(=O)CNCCC1CO1 2230a_100000711301_100000732470 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.126 NC(=O)COCCC1CC1 34a_100000754188_100000187820 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.126 NC(=O)COCCC1CC1 7a_100000754188_100000187820 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.126 NC(=O)CSCCC1CC1 62a_100000747473_100000764125 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.126 NC(=O)CSCCC1CC1 62a_100000764125_100000747473 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.126 O=C(O)CNCCC1CC1 269956a_100016091260_100000694398 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.126 O=C([O-])CNCCC1CC1 34a_100000764129_100020667443 [0,1,0,0,0,0|2,0,1]=4 232 B10R1.126 O=[N+]([O-])CNCCC1CC1 34a_100000764129_100000761209 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.138 C#CCN(C)CCC1CC1 2230a_100000225692_100000694398 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.138 C#CCN(C)CCC1CC1 34a_100000225692_100000694398 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.138 C=CCN(C)CCC1CC1 2230a_100000225617_100000694398 [0,1,0,0,0,0|2,0,1]=4 236 B10R1.138 C=CCN(C)CCC1CC1 269982a_100000225617_100000694398 [0,1,0,0,0,0|2,0,1]=4 237 B10R1.138 CC(CCN)COC1CC1 34a_106354213184_100000211595 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.138 CCCC(=O)CCC1CC1 1458a_100000211992_100000694398 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.138 CCCC(=O)CCC1CC1 1458a_100000756386_100000210303 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.138 CCCN(C)CCC1CC1 2230a_100000747261_100000694398 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.138 CCCN(C)CCC1CC1 269982a_100000747261_100000694398 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.138 CCCN(C)CCC1CO1 2230a_100000747261_100000732470 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.138 CCCN(C)CCC1CO1 269982a_100000747261_100000732470 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.138 CN(CC#N)CCC1CC1 2230a_100000748184_100000694398 [0,1,0,0,0,0|1,0,2]=4 245 B10R1.138 CN(CCO)CCC1CC1 2230a_100000210263_100000694398 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.138 CN(CCO)CCC1CC1 269982a_100000210263_100000694398 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.138 CN(CCO)CCC1CO1 2230a_100000210263_100000732470 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.138 CN(CCO)CCC1CO1 269982a_100000210263_100000732470 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.138 O=C(CCF)CCC1CC1 1458a_100000756386_100011217306 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.138 O=C(CCO)CCC1CC1 1458a_100000756386_100000211926 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.138 O=C(CCO)CCC1CC1 1458a_100011216618_100000694398 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.153 C#CC(C)NCCC1CC1 2230a_100000707721_100000694398 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.153 C#CC(C)NCCC1CC1 34a_100000707721_100000694398 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.153 C#CC(C)NCCC1CC1 34a_100000764129_200000035995 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.153 CC(C#N)NCCC1CC1 2230a_100000737613_100000694398 [0,1,0,0,0,0|1,0,2]=4 256 B10R1.153 CC(CF)OCCC1CC1 34a_100016041109_100000694398 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.153 CC(CF)OCCC1CC1 7a_100016041109_100000764125 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.153 CC(CN)COCC1CC1 34a_100000744482_100000742324 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.153 CC(CN)OCCC1CC1 34a_100000210904_100000694398 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.153 CC(CN)OCCC1CO1 34a_100000210904_100000732470 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.153 CC(CO)NCCC1CC1 34a_100000764129_100012180447 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.153 CC(CO)OCCC1CC1 34a_100000754188_100012180447 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.153 CC(CO)OCCC1CC1 7a_100000754188_100012180447 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.153 CC(CO)SCCC1CC1 62a_100012180447_100000764125 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.153 CCC(=O)NCCC1CC1 1626a_100000764129_100000210414 [0,1,0,0,0,0|2,0,1]=4 266 B10R1.153 CCC(=O)NCCC1CC1 240690a_100000764129_100000210414 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.153 CCC(=O)NCCC1CC1 527a_100000764129_100000210414 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.153 CCC(C)NCCC1CC1 2230a_100000209981_100000694398 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.153 CCC(C)NCCC1CC1 34a_100000764129_100011215416 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.153 CCC(C)NCCC1CO1 2230a_100000209981_100000732470 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.153 CCC(C)OCCC1CC1 34a_100000754188_100011215416 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.153 CCC(C)OCCC1CC1 7a_100000210228_100000764125 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.153 CCC(C)OCCC1CC1 7a_100000754188_100000758301 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.153 CCC(C)SCCC1CC1 62a_100000758301_100000764125 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.153 CCC(C)SCCC1CC1 62a_100000764125_100000758301 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.153 C[C@H](CO)NCCC1CC1 2230a_100000737577_100000694398 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.153 C[C@H](CO)NCCC1CO1 2230a_100000737577_100000732470 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.153 C[C@H](CO)SCCC1CC1 62a_100000764125_100016084084 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.153 C[C@H](CO)SCCC1CC1 62a_100016084084_100000764125 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.153 NC[C@@H](F)COCC1CC1 34a_100015665980_100000742324 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.153 O=C(CO)NCCC1CC1 240690a_100000764129_100000210174 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.153 O=C(CO)NCCC1CC1 527a_100000764129_100000210174 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.177 BrCCCCCOC1CC1 34a_100000746331_100000211595 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.177 BrCCCCOCC1CC1 34a_100011216708_100000742324 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.177 BrCCCOCCC1CC1 34a_100011217188_100000694398 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.177 BrCCOCCOC1CC1 34a_100000692535_100000211595 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.177 C#CCCNCCC1CC1 34a_100000755551_100000694398 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.177 C#CCCNCCC1CC1 34a_100000764129_100000688953 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.177 C#CCCNCCC1CO1 34a_100000755551_100000732470 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.177 C#CCCOCCC1CC1 34a_100000754188_100000688953 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.177 C#CCCOCCC1CC1 34a_100011215631_100000694398 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.177 C#CCCOCCC1CC1 7a_100000754188_100000688953 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.177 C#CCCSCCC1CC1 62a_100000688953_100000764125 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.177 C#CCCSCCC1CC1 62a_100000764125_100000688953 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.177 C/C=C/CNCCC1CC1 34a_100000764129_100102629194 [0,1,0,0,0,0|2,0,1]=4 296 B10R1.177 C=CCCNCCC1CC1 2230a_100015191253_100000694398 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.177 C=CCCNCCC1CC1 34a_100000764129_100000754431 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.177 C=CCCNCCC1CO1 2230a_100015191253_100000732470 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.177 C=CCCOCCC1CC1 34a_100000754188_100000754431 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.177 C=CCCOCCC1CC1 34a_100011205117_100000694398 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.177 C=CCCOCCC1CC1 7a_100000754188_100000754431 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.177 C=CCCSCCC1CC1 62a_100000754431_100000764125 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.177 C=CCCSCCC1CC1 62a_100000764125_100000754431 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.177 CC#CCNCCC1CC1 2230a_100000685387_100000694398 [0,1,0,0,0,0|2,0,1]=4 305 B10R1.177 CC#CCNCCC1CC1 34a_100000685387_100000694398 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.177 CC#CCNCCC1CC1 34a_100000764129_100000748600 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.177 CC=CCNCCC1CC1 34a_100000764129_100000070051 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.177 CCCCCCNC1CC1 34a_100000212008_100000210314 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.177 CCCCCCOC1CC1 34a_100000210259_100000211595 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.177 CCCCCCSC1CC1 62a_100000210314_100000211595 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.177 CCCCCNCC1CC1 2230a_100000209983_100000742324 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.177 CCCCCNCC1CC1 2230a_100000735609_100000210326 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.177 CCCCCNCC1CC1 269862a_100000209983_100000741477 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.177 CCCCCNCC1CC1 34a_100000735609_100000718602 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.177 CCCCCOCC1CC1 34a_100000210253_100000742324 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.177 CCCCCOCC1CC1 34a_100000211283_100000718602 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.177 CCCCCOCC1CC1 7a_100000210253_100000742324 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.177 CCCCCSCC1CC1 62a_100000210326_100000742324 [0,1,0,0,0,0|3,0,0]=4 319 B10R1.177 CCCCCSCC1CC1 62a_100000756562_100000210326 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.177 CCCCNCCC1CC1 2230a_100000102301_100000694398 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.177 CCCCNCCC1CC1 34a_100000764129_100000210210 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.177 CCCCNCCC1CC1 7a_106832991798_100000764125 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.177 CCCCNCCC1CO1 2230a_100000102301_100000732470 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.177 CCCCNCCC1CO1 7a_106832991798_100000732470 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.177 CCCCOCCC1CC1 34a_100000210227_100000694398 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.177 CCCCOCCC1CC1 34a_100000754188_100000210210 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.177 CCCCOCCC1CC1 7a_100000210227_100000764125 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.177 CCCCOCCC1CC1 7a_100000754188_100000210211 [0,1,0,0,0,0|3,0,0]=4 329 B10R1.177 CCCCSCCC1CC1 62a_100000210211_100000764125 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.177 CCCCSCCC1CC1 62a_100000764125_100000210210 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.177 CCCOCCNC1CC1 34a_100000212008_100011215938 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.177 CCCOCCNC1CC1 34a_100000738766_100000210303 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.177 CCCOCCNC1CC1 34a_100161115042_100000211595 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.177 CCCOCCOC1CC1 34a_100000752267_100000211595 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.177 CCCOCCSC1CC1 62a_100011215938_100000211595 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.177 CCCSCCOC1CC1 34a_200000230433_100000211595 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.177 CCOCSCCC1CC1 62a_100000739092_100000764125 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.177 CCOCSCCC1CC1 62a_100000764125_100000739092 [0,1,0,0,0,0|3,0,0]=4 339 B10R1.177 CNCCCOCC1CC1 34a_100000213112_100000742324 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.177 COCCNCCC1CC1 2230a_100000209980_100000694398 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.177 COCCNCCC1CC1 34a_100000764129_100011201679 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.177 COCCNCCC1CO1 2230a_100000209980_100000732470 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.177 COCCOCCC1CC1 34a_100000210237_100000694398 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.177 COCCOCCC1CC1 34a_100000754188_100011201679 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.177 COCCOCCC1CC1 7a_100000754188_100000233755 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.177 COCCSCCC1CC1 62a_100000233755_100000764125 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.177 COCCSCCC1CC1 62a_100000764125_100000233755 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.177 CSCCNCCC1CC1 2230a_100020590264_100000694398 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.177 CSCCNCCC1CC1 34a_100000764129_100000212216 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.177 CSCCNCCC1CO1 2230a_100020590264_100000732470 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.177 CSCCOCCC1CC1 34a_100000230434_100000694398 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.177 CSCCOCCC1CC1 34a_100000754188_100000212216 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.177 CSCCOCCC1CC1 7a_100000230434_100000764125 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.177 CSCCOCCC1CC1 7a_100000754188_100000212216 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.177 CSCCSCCC1CC1 62a_100000212216_100000764125 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.177 CSCCSCCC1CC1 62a_100000764125_100000751147 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.177 ClCCCCCOC1CC1 34a_100000746330_100000211595 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.177 ClCCCCOCC1CC1 34a_100000210776_100000742324 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.177 ClCCCCOCC1CC1 7a_100000210776_100000742324 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.177 ClCCCOCCC1CC1 34a_100000230001_100000694398 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.177 ClCCOCCOC1CC1 34a_100011215305_100000211595 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.177 FCCCCCNC1CC1 34a_100000212008_100000729378 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.177 FCCCCCSC1CC1 62a_100000729378_100000211595 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.177 FCCCCNCC1CC1 2230a_100000735609_100000729493 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.177 FCCCCNCC1CC1 34a_100000735609_100000729493 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.177 FCCCCOCC1CC1 34a_100000211283_100000729493 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.177 FCCCCOCC1CC1 34a_100011995726_100000742324 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.177 FCCCCOCC1CC1 7a_100011995726_100000742324 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.177 FCCCCSCC1CC1 62a_100000729493_100000742324 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.177 FCCCCSCC1CC1 62a_100000756562_100000729493 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.177 FCCCNCCC1CC1 2230a_100015189416_100000694398 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.177 FCCCNCCC1CC1 34a_100000764129_100011934791 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.177 FCCCNCCC1CC1 34a_100015189416_100000694398 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.177 FCCCNCCC1CO1 2230a_100015189416_100000732470 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.177 FCCCNCCC1CO1 34a_100015189416_100000732470 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.177 FCCCOCCC1CC1 34a_100000754188_100011934791 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.177 FCCCOCCC1CC1 34a_100000759539_100000694398 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.177 FCCCOCCC1CC1 7a_100000754188_100011934791 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.177 FCCCSCCC1CC1 62a_100000764125_100011934791 [0,1,0,0,0,0|3,0,0]=4 380 B10R1.177 FCCCSCCC1CC1 62a_100011934791_100000764125 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.177 FCCNCC#CC1CC1 34a_100000724931_100009895102 [0,1,0,0,0,0|2,0,1]=4 382 B10R1.177 FCCNCCCC1CO1 34a_100000724931_100000733510 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.177 FCCOCCNC1CC1 34a_100000738766_100011217306 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.177 FCCOCCOC1CC1 34a_200015357709_100000211595 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.177 ICCCCCOC1CC1 34a_200012148887_100000211595 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.177 ICCCCOCC1CC1 34a_200012148704_100000742324 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.177 ICCOCCOC1CC1 34a_100012149058_100000211595 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.177 N#CCCOCCC1CC1 7a_100000754188_100000184422 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.177 N#CCCSCCC1CC1 62a_100000764125_100011215226 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.177 N#CCCSCCC1CC1 62a_100011215226_100000764125 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.177 NCCCCCOC1CC1 34a_100000762737_100000211595 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.177 NCCCCOCC1CC1 34a_100000750430_100000742324 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.177 NCCCCOCC1CO1 34a_100000750430_102125554688 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.177 NCCCOCCC1CC1 34a_100000182051_100000694398 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.177 NCCCOCCC1CO1 34a_100000182051_100000732470 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.177 NCCOCC#CC1CC1 34a_100000210304_100009895102 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.177 NCCOCCCC1CO1 34a_100000210304_100000733510 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.177 NCCOCCOC1CC1 34a_100000211614_100000211595 [0,1,0,0,0,0|2,0,0]=3 399 B10R1.177 NOCCOCCC1CC1 34a_100000700252_100000694398 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.177 NOCCOCCC1CO1 34a_100000700252_100000732470 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.177 OCCCCCNC1CC1 34a_100000212008_100000746330 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.177 OCCCCCNC1CC1 34a_100000762737_100000211595 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.177 OCCCCCSC1CC1 62a_100000746330_100000211595 [0,1,0,0,0,0|3,0,0]=4 404 B10R1.177 OCCCCNCC1CC1 2230a_100000735609_100000210776 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.177 OCCCCNCC1CC1 2230a_100000750430_100000742324 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.177 OCCCCNCC1CC1 269862a_100000750430_100000741477 [0,1,0,0,0,0|3,0,0]=4 407 B10R1.177 OCCCCNCC1CC1 34a_100000735609_100011216708 [0,1,0,0,0,0|3,0,0]=4 408 B10R1.177 OCCCCNCC1CC1 34a_100000750430_100000742324 [0,1,0,0,0,0|3,0,0]=4 409 B10R1.177 OCCCCOCC1CC1 34a_100000211283_100011216708 [0,1,0,0,0,0|3,0,0]=4 410 B10R1.177 OCCCCSCC1CC1 62a_100000210776_100000742324 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.177 OCCCCSCC1CC1 62a_100000756562_100000210776 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.177 OCCCNCCC1CC1 34a_100000764129_100000230001 [0,1,0,0,0,0|2,0,0]=3 413 B10R1.177 OCCCOCCC1CC1 34a_100000754188_100000230001 [0,1,0,0,0,0|3,0,0]=4 414 B10R1.177 OCCCOCCC1CC1 7a_100000754188_100011215043 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.177 OCCCSCCC1CC1 62a_100000764125_100011215043 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.177 OCCCSCCC1CC1 62a_100011215043_100000764125 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.177 OCCNCC#CC1CC1 2230a_100016997473_100009895102 [0,1,0,0,0,0|2,0,1]=4 418 B10R1.177 OCCNCC#CC1CC1 34a_100016990907_100009895102 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.177 OCCNCCCC1CO1 2230a_100016997473_100000733510 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.177 OCCNCCCC1CO1 34a_100016990907_100000733510 [0,1,0,0,0,0|3,0,0]=4 421 B10R1.177 OCCOCCNC1CC1 34a_100000211614_100000211595 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.177 OCCOCCNC1CC1 34a_100000212008_100000692535 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.177 OCCOCCNC1CC1 34a_100000738766_100000211926 [0,1,0,0,0,0|3,0,0]=4 424 B10R1.177 OCCOCCSC1CC1 62a_100011215305_100000211595 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.180 C=CCNC(C)CC1CC1 270004a_100020586998_200000686933 [0,1,0,0,0,0|2,0,1]=4 426 B10R1.180 CC(CC1CC1)NCCO 270004a_100000210304_200000686933 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.180 CCCNC(=O)CC1CC1 11a_100020643023_100000738066 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.180 CCCNC(=O)CC1CC1 1626a_100020643023_100000738066 [0,1,0,0,0,0|2,0,1]=4 429 B10R1.180 CCCNC(=O)CC1CC1 240690a_100020643023_100000738066 [0,1,0,0,0,0|2,0,1]=4 430 B10R1.180 CCCNC(=O)CC1CC1 527a_100020643023_100000738066 [0,1,0,0,0,0|2,0,1]=4 431 B10R1.180 CCCNC(C)CC1CC1 270004a_100020643023_200000686933 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.180 O=C(CC1CC1)NCCF 11a_100000724931_100000738066 [0,1,0,0,0,0|2,0,1]=4 433 B10R1.180 O=C(CC1CC1)NCCF 1626a_100000724931_100000738066 [0,1,0,0,0,0|2,0,1]=4 434 B10R1.180 O=C(CC1CC1)NCCF 240690a_100000724931_100000738066 [0,1,0,0,0,0|2,0,1]=4 435 B10R1.180 O=C(CC1CC1)NCCF 527a_100000724931_100000738066 [0,1,0,0,0,0|2,0,1]=4 436 B10R1.180 O=C(CC1CC1)NCCO 240690a_100000210304_100000738066 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.180 O=C(CC1CC1)NCCO 527a_100000210304_100000738066 [0,1,0,0,0,0|2,0,1]=4 438 B10R1.186 C#CCNCC(O)C1CC1 2230a_100000751198_100000038162 [0,1,0,0,0,0|2,0,1]=4 439 B10R1.186 C#CCNCC(O)C1CC1 34a_100000751198_100000184674 [0,1,0,0,0,0|2,0,1]=4 440 B10R1.186 C=CCNCC(O)C1CC1 2230a_100000751198_100000210623 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.186 C=CCNCC(O)C1CC1 34a_100000751198_100015514636 [0,1,0,0,0,0|2,0,1]=4 442 B10R1.186 CCCNCC(O)C1CC1 2230a_100000751198_100000210303 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.186 CCCNCC(O)C1CC1 34a_100000751198_100000210303 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.186 CCCOC[C@H](N)C1CC1 34a_100020623730_100000210303 [0,1,0,0,0,0|3,0,0]=4 445 B10R1.186 COCNCC(O)C1CC1 2230a_100000751198_100000766300 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.186 CSCNCC(O)C1CC1 2230a_100000751198_100011218213 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.186 CSCNCC(O)C1CC1 34a_100000751198_100011218213 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.186 N#CCNCC(O)C1CC1 2230a_100000751198_100011215382 [0,1,0,0,0,0|1,0,2]=4 449 B10R1.186 NCCOCC(=O)C1CC1 34a_100000210304_100000746382 [0,1,0,0,0,0|2,0,1]=4 450 B10R1.186 N[C@@H](COCCF)C1CC1 34a_100020623730_100011217306 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.186 N[C@@H](COCCO)C1CC1 34a_100020623730_100000211926 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.186 O=C(CNCCF)C1CC1 34a_100000724931_100000746382 [0,1,0,0,0,0|2,0,1]=4 453 B10R1.186 O=C(CNCCO)C1CC1 2230a_100016997473_100000746382 [0,1,0,0,0,0|2,0,1]=4 454 B10R1.186 O=C(CNCCO)C1CC1 34a_100016990907_100000746382 [0,1,0,0,0,0|2,0,1]=4 455 B10R1.186 O=CCNCC(O)C1CC1 2230a_100000751198_200015260668 [0,1,0,0,0,0|2,0,1]=4 456 B10R1.186 O=CCNCC(O)C1CC1 34a_100000751198_200009817547 [0,1,0,0,0,0|2,0,1]=4 457 B10R1.186 OC(CNCCF)C1CC1 2230a_100000751198_100011217306 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.186 OC(CNCCF)C1CC1 34a_100000751198_100011217306 [0,1,0,0,0,0|2,0,0]=3 459 B10R1.186 OCCNCC(O)C1CC1 2230a_100000751198_100000211926 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.186 OCCNCC(O)C1CC1 34a_100000751198_100000211926 [0,1,0,0,0,0|2,0,0]=3 461 B8R0.4 C#CCCCCNCC 2230a_100000706060_100000210202 [0,0,1,0,0,0|2,0,1]=4 462 B8R0.4 C#CCCCCNCC 2230a_100015525214_100010269958 [0,0,1,0,0,0|2,0,1]=4 463 B8R0.4 C#CCCCCNCC 34a_100000706060_100000210202 [0,0,1,0,0,0|2,0,1]=4 464 B8R0.4 C#CCNCCCCC 2230a_100000209983_100000038162 [0,0,1,0,0,0|2,0,1]=4 465 B8R0.4 C#CCNCCCCC 34a_100000212058_100000718602 [0,0,1,0,0,0|2,0,1]=4 466 B8R0.4 C#CCNCCOCC 2230a_102516460346_100000038162 [0,0,1,0,0,0|2,0,1]=4 467 B8R0.4 C#CCNCCOCC 34a_100000212058_100000210147 [0,0,1,0,0,0|2,0,1]=4 468 B8R0.4 C#CCNCCOCC 34a_102516460346_100000184674 [0,0,1,0,0,0|2,0,1]=4 469 B8R0.4 C#CCNCCSCC 2230a_100000106463_100000038162 [0,0,1,0,0,0|2,0,1]=4 470 B8R0.4 C#CCNCCSCC 34a_100000212058_100000757381 [0,0,1,0,0,0|2,0,1]=4 471 B8R0.4 C#CCOCCNCC 2230a_100000700922_100000210202 [0,0,1,0,0,0|2,0,1]=4 472 B8R0.4 C#CCOCCNCC 2230a_100015525214_100010402529 [0,0,1,0,0,0|2,0,1]=4 473 B8R0.4 C#CCOCCNCC 34a_100000700922_100000210202 [0,0,1,0,0,0|2,0,1]=4 474 B8R0.4 C=CCCCCNCC 2230a_100000703577_100000210202 [0,0,1,0,0,0|2,0,1]=4 475 B8R0.4 C=CCCCCNCC 2230a_100015525214_100011215482 [0,0,1,0,0,0|2,0,1]=4 476 B8R0.4 C=CCCCCNCC 34a_100000703577_100000210202 [0,0,1,0,0,0|2,0,1]=4 477 B8R0.4 C=CCNCCCCC 2230a_100000209983_100000210623 [0,0,1,0,0,0|2,0,1]=4 478 B8R0.4 C=CCNCCCCC 2230a_100020586998_100000210326 [0,0,1,0,0,0|2,0,1]=4 479 B8R0.4 C=CCNCCOCC 2230a_100020586998_100011215890 [0,0,1,0,0,0|2,0,1]=4 480 B8R0.4 C=CCNCCOCC 2230a_102516460346_100000210623 [0,0,1,0,0,0|2,0,1]=4 481 B8R0.4 C=CCNCCOCC 34a_102516460346_100015514636 [0,0,1,0,0,0|2,0,1]=4 482 B8R0.4 C=CCNCCSCC 2230a_100000106463_100000210623 [0,0,1,0,0,0|2,0,1]=4 483 B8R0.4 C=CCNCCSCC 2230a_100020586998_100000757381 [0,0,1,0,0,0|2,0,1]=4 484 B8R0.4 CC/C=C\CCNCC 2230a_100015525214_100015370543 [0,0,1,0,0,0|2,0,1]=4 485 B8R0.4 CC/C=C\CNCCF 34a_100000724931_100103147603 [0,0,1,0,0,0|2,0,1]=4 486 B8R0.4 CC/C=C\CNCCO 2230a_100016997473_100103147603 [0,0,1,0,0,0|2,0,1]=4 487 B8R0.4 CC/C=C\CNCCO 34a_100016990907_100103147603 [0,0,1,0,0,0|2,0,1]=4 488 B8R0.4 CC/C=C\COCCN 34a_100000210304_100103147603 [0,0,1,0,0,0|2,0,1]=4 489 B8R0.4 CCC#CCNCCF 34a_100000724931_100009813939 [0,0,1,0,0,0|2,0,1]=4 490 B8R0.4 CCC#CCNCCO 2230a_100016997473_100009813939 [0,0,1,0,0,0|2,0,1]=4 491 B8R0.4 CCC#CCNCCO 34a_100016990907_100009813939 [0,0,1,0,0,0|2,0,1]=4 492 B8R0.4 CCC#CCOCCN 34a_100000210304_100009813939 [0,0,1,0,0,0|2,0,1]=4 493 B8R0.4 CCCCCCNCC 2230a_100000210581_100000210202 [0,0,1,0,0,0|2,0,0]=3 494 B8R0.4 CCCCCCNCC 2230a_100015525214_100000210314 [0,0,1,0,0,0|2,0,0]=3 495 B8R0.4 CCCCCCOCC 34a_100000210259_100000210202 [0,0,1,0,0,0|3,0,0]=4 496 B8R0.4 CCCCCCOCC 34a_100121572206_100000210314 [0,0,1,0,0,0|3,0,0]=4 497 B8R0.4 CCCCCCOCC 7a_100000210259_100000210202 [0,0,1,0,0,0|3,0,0]=4 498 B8R0.4 CCCCCCSCC 62a_100000210202_100000210757 [0,0,1,0,0,0|3,0,0]=4 499 B8R0.4 CCCCCCSCC 62a_100000210314_100000210202 [0,0,1,0,0,0|3,0,0]=4 500 B8R0.4 CCCCCNCC#N 2230a_100000209983_100011215382 [0,0,1,0,0,0|1,0,2]=4 501 B8R0.4 CCCCCNCC=O 2230a_100000209983_200015260668 [0,0,1,0,0,0|2,0,1]=4 502 B8R0.4 CCCCCNCCC 2230a_100000209983_100000210303 [0,0,1,0,0,0|2,0,0]=3 503 B8R0.4 CCCCCNCCF 2230a_100000209983_100011217306 [0,0,1,0,0,0|2,0,0]=3 504 B8R0.4 CCCCCNCCF 34a_100000724931_100000718602 [0,0,1,0,0,0|2,0,0]=3 505 B8R0.4 CCCCCNCCO 2230a_100000209983_100000211926 [0,0,1,0,0,0|2,0,0]=3 506 B8R0.4 CCCCCNCCO 2230a_100016997473_100000210326 [0,0,1,0,0,0|2,0,0]=3 507 B8R0.4 CCCCCNCCO 34a_100016990907_100000718602 [0,0,1,0,0,0|2,0,0]=3 508 B8R0.4 CCCCCNCOC 2230a_100000209983_100000766300 [0,0,1,0,0,0|3,0,0]=4 509 B8R0.4 CCCCCNCSC 2230a_100000209983_100011218213 [0,0,1,0,0,0|3,0,0]=4 510 B8R0.4 CCCCCOCCBr 34a_100000211926_100000718602 [0,0,1,0,0,0|3,0,0]=4 511 B8R0.4 CCCCCOCCC 34a_100000210253_100000210303 [0,0,1,0,0,0|3,0,0]=4 512 B8R0.4 CCCCCOCCC 34a_100000210258_100000718602 [0,0,1,0,0,0|3,0,0]=4 513 B8R0.4 CCCCCOCCC 7a_100000210253_100000210303 [0,0,1,0,0,0|3,0,0]=4 514 B8R0.4 CCCCCOCCF 34a_100000210253_100011217306 [0,0,1,0,0,0|3,0,0]=4 515 B8R0.4 CCCCCOCCF 7a_100000210253_100011217306 [0,0,1,0,0,0|3,0,0]=4 516 B8R0.4 CCCCCOCCN 34a_100000210304_100000718602 [0,0,1,0,0,0|2,0,0]=3 517 B8R0.4 CCCCCOCCO 34a_100000210253_100000211926 [0,0,1,0,0,0|3,0,0]=4 518 B8R0.4 CCCCCOCCO 7a_100000210253_100000211926 [0,0,1,0,0,0|3,0,0]=4 519 B8R0.4 CCCCCSCCC 62a_100000210303_100000210326 [0,0,1,0,0,0|3,0,0]=4 520 B8R0.4 CCCCCSCCC 62a_100000210326_100000210303 [0,0,1,0,0,0|3,0,0]=4 521 B8R0.4 CCCCCSCCF 62a_100000210326_100011217306 [0,0,1,0,0,0|3,0,0]=4 522 B8R0.4 CCCCCSCCF 62a_100011217306_100000210326 [0,0,1,0,0,0|3,0,0]=4 523 B8R0.4 CCCCCSCCO 62a_100000210326_100000211926 [0,0,1,0,0,0|3,0,0]=4 524 B8R0.4 CCCCCSCCO 62a_100000211926_100000210326 [0,0,1,0,0,0|3,0,0]=4 525 B8R0.4 CCCCOCCCN 34a_100000182051_100000210210 [0,0,1,0,0,0|3,0,0]=4 526 B8R0.4 CCCCOCNCC 2230a_100015525214_100011995733 [0,0,1,0,0,0|3,0,0]=4 527 B8R0.4 CCCNCCCCO 2230a_100000750430_100000210303 [0,0,1,0,0,0|3,0,0]=4 528 B8R0.4 CCCNCCCCO 34a_100000750430_100000210303 [0,0,1,0,0,0|3,0,0]=4 529 B8R0.4 CCCNCCCOC 34a_100150723488_100000210303 [0,0,1,0,0,0|3,0,0]=4 530 B8R0.4 CCCNCCCSC 2230a_100000749238_100000210303 [0,0,1,0,0,0|3,0,0]=4 531 B8R0.4 CCCNCCOCC 2230a_102516460346_100000210303 [0,0,1,0,0,0|2,0,0]=3 532 B8R0.4 CCCNCCOCC 34a_102516460346_100000210303 [0,0,1,0,0,0|2,0,0]=3 533 B8R0.4 CCCNCCSCC 2230a_100000106463_100000210303 [0,0,1,0,0,0|2,0,0]=3 534 B8R0.4 CCCOCCCCN 34a_100000750430_100000210303 [0,0,1,0,0,0|3,0,0]=4 535 B8R0.4 CCCOCCNCC 2230a_100015525214_100011215938 [0,0,1,0,0,0|2,0,0]=3 536 B8R0.4 CCCOCCNCC 2230a_100161115042_100000210202 [0,0,1,0,0,0|2,0,0]=3 537 B8R0.4 CCCOCCNCC 34a_100161115042_100000210202 [0,0,1,0,0,0|2,0,0]=3 538 B8R0.4 CCCOCCNCF 34a_100161115042_100015361967 [0,0,1,0,0,0|3,0,0]=4 539 B8R0.4 CCCOCCOCC 34a_100000210136_100000210303 [0,0,1,0,0,0|3,0,0]=4 540 B8R0.4 CCCOCCOCC 34a_100000210258_100000210147 [0,0,1,0,0,0|3,0,0]=4 541 B8R0.4 CCCOCCOCC 34a_100000752267_100000210202 [0,0,1,0,0,0|3,0,0]=4 542 B8R0.4 CCCOCCOCC 34a_100121572206_100011215938 [0,0,1,0,0,0|3,0,0]=4 543 B8R0.4 CCCOCCOCC 7a_100000210136_100000210303 [0,0,1,0,0,0|3,0,0]=4 544 B8R0.4 CCCOCCOCC 7a_100000752267_100000210202 [0,0,1,0,0,0|3,0,0]=4 545 B8R0.4 CCCOCCSCC 34a_100000210258_100000757381 [0,0,1,0,0,0|3,0,0]=4 546 B8R0.4 CCCOCCSCC 34a_100000212035_100000210303 [0,0,1,0,0,0|3,0,0]=4 547 B8R0.4 CCCOCCSCC 62a_100000210202_100011215938 [0,0,1,0,0,0|3,0,0]=4 548 B8R0.4 CCCOCCSCC 62a_100011215938_100000210202 [0,0,1,0,0,0|3,0,0]=4 549 B8R0.4 CCCOCCSCC 7a_100000212035_100000210303 [0,0,1,0,0,0|3,0,0]=4 550 B8R0.4 CCCSCCNCC 2230a_100020603323_100000210202 [0,0,1,0,0,0|2,0,0]=3 551 B8R0.4 CCCSCCOCC 34a_200000230433_100000210202 [0,0,1,0,0,0|3,0,0]=4 552 B8R0.4 CCCSCCOCC 62a_100000210147_100000210303 [0,0,1,0,0,0|3,0,0]=4 553 B8R0.4 CCCSCCOCC 62a_100000210303_100011215890 [0,0,1,0,0,0|3,0,0]=4 554 B8R0.4 CCCSCCOCC 7a_200000230433_100000210202 [0,0,1,0,0,0|3,0,0]=4 555 B8R0.4 CCCSCCSCC 62a_100000210303_100000757381 [0,0,1,0,0,0|3,0,0]=4 556 B8R0.4 CCCSCCSCC 62a_100000757381_100000210303 [0,0,1,0,0,0|3,0,0]=4 557 B8R0.4 CCNCCCCC#N 2230a_100015525214_100000211819 [0,0,1,0,0,0|1,0,2]=4 558 B8R0.4 CCNCCCCC=O 2230a_100015525214_100000139335 [0,0,1,0,0,0|2,0,1]=4 559 B8R0.4 CCNCCCCCF 2230a_100015525214_100000729378 [0,0,1,0,0,0|2,0,0]=3 560 B8R0.4 CCNCCCCCO 2230a_100000762737_100000210202 [0,0,1,0,0,0|2,0,0]=3 561 B8R0.4 CCNCCCCCO 2230a_100015525214_100000746330 [0,0,1,0,0,0|2,0,0]=3 562 B8R0.4 CCNCCCCCO 34a_100000762737_100000210202 [0,0,1,0,0,0|2,0,0]=3 563 B8R0.4 CCNCCCCOC 2230a_100015525214_100000730899 [0,0,1,0,0,0|3,0,0]=4 564 B8R0.4 CCNCCCOCC 2230a_100000210961_100000210202 [0,0,1,0,0,0|3,0,0]=4 565 B8R0.4 CCNCCCOCC 2230a_100015525214_100012232248 [0,0,1,0,0,0|3,0,0]=4 566 B8R0.4 CCNCCCOCC 34a_100000210961_100000210202 [0,0,1,0,0,0|3,0,0]=4 567 B8R0.4 CCNCCOCC#N 2230a_100015525214_200000047693 [0,0,1,0,0,0|1,0,2]=4 568 B8R0.4 CCNCCOCCO 2230a_100000211614_100000210202 [0,0,1,0,0,0|2,0,0]=3 569 B8R0.4 CCNCCOCCO 2230a_100015525214_100011215305 [0,0,1,0,0,0|2,0,0]=3 570 B8R0.4 CCNCCOCCO 34a_100000211614_100000210202 [0,0,1,0,0,0|2,0,0]=3 571 B8R0.4 CCNCCSCCO 2230a_100011219999_100000210202 [0,0,1,0,0,0|2,0,0]=3 572 B8R0.4 CCOCCCCCBr 34a_100000746331_100000210202 [0,0,1,0,0,0|3,0,0]=4 573 B8R0.4 CCOCCCCCBr 7a_100000746331_100000210202 [0,0,1,0,0,0|3,0,0]=4 574 B8R0.4 CCOCCCCCCl 34a_100000746330_100000210202 [0,0,1,0,0,0|3,0,0]=4 575 B8R0.4 CCOCCCCCCl 7a_100000746330_100000210202 [0,0,1,0,0,0|3,0,0]=4 576 B8R0.4 CCOCCCCCF 34a_100121572206_100000729378 [0,0,1,0,0,0|3,0,0]=4 577 B8R0.4 CCOCCCCCI 34a_200012148887_100000210202 [0,0,1,0,0,0|3,0,0]=4 578 B8R0.4 CCOCCCCCI 7a_200012148887_100000210202 [0,0,1,0,0,0|3,0,0]=4 579 B8R0.4 CCOCCCCCN 34a_100000762737_100000210202 [0,0,1,0,0,0|2,0,0]=3 580 B8R0.4 CCOCCCCCO 34a_100121572206_100000746330 [0,0,1,0,0,0|3,0,0]=4 581 B8R0.4 CCOCCNCC#N 2230a_102516460346_100011215382 [0,0,1,0,0,0|1,0,2]=4 582 B8R0.4 CCOCCNCC=O 2230a_102516460346_200015260668 [0,0,1,0,0,0|2,0,1]=4 583 B8R0.4 CCOCCNCC=O 34a_102516460346_200009817547 [0,0,1,0,0,0|2,0,1]=4 584 B8R0.4 CCOCCNCCF 2230a_102516460346_100011217306 [0,0,1,0,0,0|2,0,0]=3 585 B8R0.4 CCOCCNCCF 34a_100000724931_100000210147 [0,0,1,0,0,0|2,0,0]=3 586 B8R0.4 CCOCCNCCF 34a_102516460346_100011217306 [0,0,1,0,0,0|2,0,0]=3 587 B8R0.4 CCOCCNCCO 2230a_100016997473_100011215890 [0,0,1,0,0,0|2,0,0]=3 588 B8R0.4 CCOCCNCCO 2230a_102516460346_100000211926 [0,0,1,0,0,0|2,0,0]=3 589 B8R0.4 CCOCCNCCO 34a_100016990907_100000210147 [0,0,1,0,0,0|2,0,0]=3 590 B8R0.4 CCOCCNCCO 34a_102516460346_100000211926 [0,0,1,0,0,0|2,0,0]=3 591 B8R0.4 CCOCCNCOC 2230a_102516460346_100000766300 [0,0,1,0,0,0|3,0,0]=4 592 B8R0.4 CCOCCNCSC 2230a_102516460346_100011218213 [0,0,1,0,0,0|3,0,0]=4 593 B8R0.4 CCOCCNCSC 34a_102516460346_100011218213 [0,0,1,0,0,0|3,0,0]=4 594 B8R0.4 CCOCCOCCBr 34a_100000211926_100000210147 [0,0,1,0,0,0|3,0,0]=4 595 B8R0.4 CCOCCOCCBr 34a_100000692535_100000210202 [0,0,1,0,0,0|3,0,0]=4 596 B8R0.4 CCOCCOCCBr 7a_100000692535_100000210202 [0,0,1,0,0,0|3,0,0]=4 597 B8R0.4 CCOCCOCCCl 34a_100011215305_100000210202 [0,0,1,0,0,0|3,0,0]=4 598 B8R0.4 CCOCCOCCCl 7a_100011215305_100000210202 [0,0,1,0,0,0|3,0,0]=4 599 B8R0.4 CCOCCOCCF 34a_100000210136_100011217306 [0,0,1,0,0,0|3,0,0]=4 600 B8R0.4 CCOCCOCCF 34a_200015357709_100000210202 [0,0,1,0,0,0|3,0,0]=4 601 B8R0.4 CCOCCOCCF 7a_100000210136_100011217306 [0,0,1,0,0,0|3,0,0]=4 602 B8R0.4 CCOCCOCCF 7a_200015357709_100000210202 [0,0,1,0,0,0|3,0,0]=4 603 B8R0.4 CCOCCOCCI 34a_100012149058_100000210202 [0,0,1,0,0,0|3,0,0]=4 604 B8R0.4 CCOCCOCCI 7a_100012149058_100000210202 [0,0,1,0,0,0|3,0,0]=4 605 B8R0.4 CCOCCOCCN 34a_100000210304_100000210147 [0,0,1,0,0,0|2,0,0]=3 606 B8R0.4 CCOCCOCCN 34a_100000211614_100000210202 [0,0,1,0,0,0|2,0,0]=3 607 B8R0.4 CCOCCOCCO 34a_100000210136_100000211926 [0,0,1,0,0,0|3,0,0]=4 608 B8R0.4 CCOCCOCCO 34a_100121572206_100000692535 [0,0,1,0,0,0|3,0,0]=4 609 B8R0.4 CCOCCOCCO 7a_100000210136_100000211926 [0,0,1,0,0,0|3,0,0]=4 610 B8R0.4 CCOCCSCCF 62a_100000210147_100011217306 [0,0,1,0,0,0|3,0,0]=4 611 B8R0.4 CCOCCSCCF 62a_100011217306_100011215890 [0,0,1,0,0,0|3,0,0]=4 612 B8R0.4 CCOCCSCCO 62a_100000210147_100000211926 [0,0,1,0,0,0|3,0,0]=4 613 B8R0.4 CCOCCSCCO 62a_100000211926_100011215890 [0,0,1,0,0,0|3,0,0]=4 614 B8R0.4 CCSCCCCCF 62a_100000210202_100000729378 [0,0,1,0,0,0|3,0,0]=4 615 B8R0.4 CCSCCCCCF 62a_100000729378_100000210202 [0,0,1,0,0,0|3,0,0]=4 616 B8R0.4 CCSCCCCCO 62a_100000210202_100000746330 [0,0,1,0,0,0|3,0,0]=4 617 B8R0.4 CCSCCCCCO 62a_100000746330_100000210202 [0,0,1,0,0,0|3,0,0]=4 618 B8R0.4 CCSCCNCC#N 2230a_100000106463_100011215382 [0,0,1,0,0,0|1,0,2]=4 619 B8R0.4 CCSCCNCC=O 2230a_100000106463_200015260668 [0,0,1,0,0,0|2,0,1]=4 620 B8R0.4 CCSCCNCCF 2230a_100000106463_100011217306 [0,0,1,0,0,0|2,0,0]=3 621 B8R0.4 CCSCCNCCF 34a_100000724931_100000757381 [0,0,1,0,0,0|2,0,0]=3 622 B8R0.4 CCSCCNCCO 2230a_100000106463_100000211926 [0,0,1,0,0,0|2,0,0]=3 623 B8R0.4 CCSCCNCCO 2230a_100016997473_100000757381 [0,0,1,0,0,0|2,0,0]=3 624 B8R0.4 CCSCCNCCO 34a_100016990907_100000757381 [0,0,1,0,0,0|2,0,0]=3 625 B8R0.4 CCSCCNCOC 2230a_100000106463_100000766300 [0,0,1,0,0,0|3,0,0]=4 626 B8R0.4 CCSCCNCSC 2230a_100000106463_100011218213 [0,0,1,0,0,0|3,0,0]=4 627 B8R0.4 CCSCCOCCBr 34a_100000211926_100000757381 [0,0,1,0,0,0|3,0,0]=4 628 B8R0.4 CCSCCOCCF 34a_100000212035_100011217306 [0,0,1,0,0,0|3,0,0]=4 629 B8R0.4 CCSCCOCCF 7a_100000212035_100011217306 [0,0,1,0,0,0|3,0,0]=4 630 B8R0.4 CCSCCOCCN 34a_100000210304_100000757381 [0,0,1,0,0,0|2,0,0]=3 631 B8R0.4 CCSCCOCCO 34a_100000212035_100000211926 [0,0,1,0,0,0|3,0,0]=4 632 B8R0.4 CCSCCOCCO 62a_100000210202_100011215305 [0,0,1,0,0,0|3,0,0]=4 633 B8R0.4 CCSCCOCCO 62a_100011215305_100000210202 [0,0,1,0,0,0|3,0,0]=4 634 B8R0.4 CCSCCOCCO 7a_100000212035_100000211926 [0,0,1,0,0,0|3,0,0]=4 635 B8R0.4 CCSCCSCCF 62a_100000757381_100011217306 [0,0,1,0,0,0|3,0,0]=4 636 B8R0.4 CCSCCSCCF 62a_100011217306_100000757381 [0,0,1,0,0,0|3,0,0]=4 637 B8R0.4 CCSCCSCCO 62a_100000211926_100000757381 [0,0,1,0,0,0|3,0,0]=4 638 B8R0.4 CCSCCSCCO 62a_100000757381_100000211926 [0,0,1,0,0,0|3,0,0]=4 639 B8R0.4 COCCCCCCN 34a_100000686447_200000210301 [0,0,1,0,0,0|3,0,0]=4 640 B8R0.4 COCCCNCCF 34a_100000724931_100000740836 [0,0,1,0,0,0|3,0,0]=4 641 B8R0.4 COCCCNCCF 34a_100150723488_100011217306 [0,0,1,0,0,0|3,0,0]=4 642 B8R0.4 COCCCNCCO 2230a_100016997473_100000740836 [0,0,1,0,0,0|3,0,0]=4 643 B8R0.4 COCCCNCCO 34a_100016990907_100000740836 [0,0,1,0,0,0|3,0,0]=4 644 B8R0.4 COCCCNCCO 34a_100150723488_100000211926 [0,0,1,0,0,0|3,0,0]=4 645 B8R0.4 COCCCOCCN 34a_100000210304_100000740836 [0,0,1,0,0,0|3,0,0]=4 646 B8R0.4 CSCCCNCCF 2230a_100000749238_100011217306 [0,0,1,0,0,0|3,0,0]=4 647 B8R0.4 CSCCCNCCO 2230a_100000749238_100000211926 [0,0,1,0,0,0|3,0,0]=4 648 B8R0.4 FCCCCNCCF 34a_100000724931_100000729493 [0,0,1,0,0,0|3,0,0]=4 649 B8R0.4 NCCCCCOCF 34a_100000762737_100015361967 [0,0,1,0,0,0|3,0,0]=4 650 B8R0.4 NCCOCCCCF 34a_100000210304_100000729493 [0,0,1,0,0,0|3,0,0]=4 651 B8R0.4 NCCOCCCCO 34a_100000210304_100011216708 [0,0,1,0,0,0|3,0,0]=4 652 B8R0.4 NCCOCCOCF 34a_100000211614_100015361967 [0,0,1,0,0,0|3,0,0]=4 653 B8R0.4 OCCCCCNCF 34a_100000762737_100015361967 [0,0,1,0,0,0|3,0,0]=4 654 B8R0.4 OCCCCNCCF 2230a_100000750430_100011217306 [0,0,1,0,0,0|3,0,0]=4 655 B8R0.4 OCCCCNCCF 34a_100000724931_100011216708 [0,0,1,0,0,0|3,0,0]=4 656 B8R0.4 OCCCCNCCF 34a_100000750430_100011217306 [0,0,1,0,0,0|3,0,0]=4 657 B8R0.4 OCCCCNCCO 2230a_100000750430_100000211926 [0,0,1,0,0,0|3,0,0]=4 658 B8R0.4 OCCCCNCCO 2230a_100016997473_100000210776 [0,0,1,0,0,0|3,0,0]=4 659 B8R0.4 OCCCCNCCO 34a_100000750430_100000211926 [0,0,1,0,0,0|3,0,0]=4 660 B8R0.4 OCCCCNCCO 34a_100016990907_100011216708 [0,0,1,0,0,0|3,0,0]=4 661 B8R0.4 OCCNCCCCF 2230a_100016997473_100000729493 [0,0,1,0,0,0|3,0,0]=4 662 B8R0.4 OCCNCCCCF 34a_100016990907_100000729493 [0,0,1,0,0,0|3,0,0]=4 663 B8R0.4 OCCOCCNCF 34a_100000211614_100015361967 [0,0,1,0,0,0|3,0,0]=4 664 B8R0.4 [13CH3]OCCCCCCN 34a_100000686447_200025704644 [0,0,1,0,0,0|3,0,0]=4 665 B8R0.7 C#CCCCCN(C)C 2230a_100102631434_100010269958 [0,0,1,0,0,0|2,0,1]=4 666 B8R0.7 C#CCCCCN(C)C 269982a_100102631434_100010269958 [0,0,1,0,0,0|2,0,1]=4 667 B8R0.7 C#CCNCCC(C)C 34a_100000212058_100000210312 [0,0,1,0,0,0|2,0,1]=4 668 B8R0.7 C#CCOCCN(C)C 2230a_100102631434_100010402529 [0,0,1,0,0,0|2,0,1]=4 669 B8R0.7 C#CCSCCN(C)C 62a_100000038162_100000755713 [0,0,1,0,0,0|2,0,1]=4 670 B8R0.7 C=C(C)CCNCCF 34a_100000724931_100000730704 [0,0,1,0,0,0|2,0,1]=4 671 B8R0.7 C=C(C)CCNCCO 2230a_100016997473_100000730704 [0,0,1,0,0,0|2,0,1]=4 672 B8R0.7 C=C(C)CCNCCO 34a_100016990907_100000730704 [0,0,1,0,0,0|2,0,1]=4 673 B8R0.7 C=C(C)CCOCCN 34a_100000210304_100000730704 [0,0,1,0,0,0|2,0,1]=4 674 B8R0.7 C=CCCCCN(C)C 2230a_100012000471_200000210301 [0,0,1,0,0,0|2,0,1]=4 675 B8R0.7 C=CCCCCN(C)C 2230a_100102631434_100011215482 [0,0,1,0,0,0|2,0,1]=4 676 B8R0.7 C=CCCCCN(C)C 269982a_100012000471_200000210301 [0,0,1,0,0,0|2,0,1]=4 677 B8R0.7 C=CCCCCN(C)C 269982a_100102631434_100011215482 [0,0,1,0,0,0|2,0,1]=4 678 B8R0.7 C=CCCCCN(C)[13CH3] 2230a_100012000471_200025704644 [0,0,1,0,0,0|2,0,1]=4 679 B8R0.7 C=CCCCCN(C)[13CH3] 269982a_100012000471_200025704644 [0,0,1,0,0,0|2,0,1]=4 680 B8R0.7 C=CCNCCC(C)C 2230a_100020586998_100000210312 [0,0,1,0,0,0|2,0,1]=4 681 B8R0.7 C=CCSCCN(C)C 62a_100000210623_100000755713 [0,0,1,0,0,0|2,0,1]=4 682 B8R0.7 CC(=CCNCCF)C 34a_100000718196_100011217306 [0,0,1,0,0,0|2,0,1]=4 683 B8R0.7 CC(=CCNCCF)C 34a_100000724931_100000761012 [0,0,1,0,0,0|2,0,1]=4 684 B8R0.7 CC(=CCNCCO)C 2230a_100016997473_100000761012 [0,0,1,0,0,0|2,0,1]=4 685 B8R0.7 CC(=CCNCCO)C 34a_100000718196_100000211926 [0,0,1,0,0,0|2,0,1]=4 686 B8R0.7 CC(=CCNCCO)C 34a_100016990907_100000761012 [0,0,1,0,0,0|2,0,1]=4 687 B8R0.7 CC(=CCOCCN)C 34a_100000210304_100000761012 [0,0,1,0,0,0|2,0,1]=4 688 B8R0.7 CC(C)CCNCCF 269862a_100000724931_100000185833 [0,0,1,0,0,0|2,0,0]=3 689 B8R0.7 CC(C)CCNCCF 34a_100000724931_100000210312 [0,0,1,0,0,0|2,0,0]=3 690 B8R0.7 CC(C)CCNCCO 2230a_100016997473_100000210312 [0,0,1,0,0,0|2,0,0]=3 691 B8R0.7 CC(C)CCNCCO 269862a_100000210304_100000185833 [0,0,1,0,0,0|2,0,0]=3 692 B8R0.7 CC(C)CCNCCO 34a_100016990907_100000210312 [0,0,1,0,0,0|2,0,0]=3 693 B8R0.7 CC(C)CCOCCBr 34a_100000211926_100000210312 [0,0,1,0,0,0|3,0,0]=4 694 B8R0.7 CC(C)CCOCCF 34a_100000210254_100011217306 [0,0,1,0,0,0|3,0,0]=4 695 B8R0.7 CC(C)CCOCCF 7a_100000210254_100011217306 [0,0,1,0,0,0|3,0,0]=4 696 B8R0.7 CC(C)CCOCCN 34a_100000210304_100000210312 [0,0,1,0,0,0|2,0,0]=3 697 B8R0.7 CC(C)CCOCCO 34a_100000210254_100000211926 [0,0,1,0,0,0|3,0,0]=4 698 B8R0.7 CC(C)CCOCCO 7a_100000210254_100000211926 [0,0,1,0,0,0|3,0,0]=4 699 B8R0.7 CC(C)CCSCCF 62a_100000210312_100011217306 [0,0,1,0,0,0|3,0,0]=4 700 B8R0.7 CC(C)CCSCCF 62a_100011217306_100000210312 [0,0,1,0,0,0|3,0,0]=4 701 B8R0.7 CC(C)CCSCCO 62a_100000210312_100000211926 [0,0,1,0,0,0|3,0,0]=4 702 B8R0.7 CC(C)CCSCCO 62a_100000211926_100000210312 [0,0,1,0,0,0|3,0,0]=4 703 B8R0.7 CC(C)COCCCN 34a_100000182051_100000210624 [0,0,1,0,0,0|3,0,0]=4 704 B8R0.7 CC(C)OCCCCN 34a_100000750430_100000210206 [0,0,1,0,0,0|3,0,0]=4 705 B8R0.7 CC(C)OCNCCF 34a_100000724931_100000709892 [0,0,1,0,0,0|3,0,0]=4 706 B8R0.7 CC(C)OCNCCO 2230a_100016997473_100000709892 [0,0,1,0,0,0|3,0,0]=4 707 B8R0.7 CC(C)OCNCCO 34a_100016990907_100000709892 [0,0,1,0,0,0|3,0,0]=4 708 B8R0.7 CC(C)OCOCCN 34a_100000210304_100000709892 [0,0,1,0,0,0|3,0,0]=4 709 B8R0.7 CC(O)CCNCCF 2230a_200000755665_100011217306 [0,0,1,0,0,0|3,0,0]=4 710 B8R0.7 CC(O)CCNCCF 34a_100000724931_100012276601 [0,0,1,0,0,0|3,0,0]=4 711 B8R0.7 CC(O)CCNCCO 2230a_100016997473_100012276601 [0,0,1,0,0,0|3,0,0]=4 712 B8R0.7 CC(O)CCNCCO 2230a_200000755665_100000211926 [0,0,1,0,0,0|3,0,0]=4 713 B8R0.7 CC(O)CCNCCO 34a_100016990907_100012276601 [0,0,1,0,0,0|3,0,0]=4 714 B8R0.7 CC(O)CCOCCN 34a_100000210304_100012276601 [0,0,1,0,0,0|3,0,0]=4 715 B8R0.7 CC/C=C\CCN(C)C 2230a_100102631434_100015370543 [0,0,1,0,0,0|2,0,1]=4 716 B8R0.7 CC/C=C\CCN(C)C 269982a_100102631434_100015370543 [0,0,1,0,0,0|2,0,1]=4 717 B8R0.7 CCCCCCN(C)C 2230a_100102631434_100000210314 [0,0,1,0,0,0|2,0,0]=3 718 B8R0.7 CCCCCCN(C)C 2230a_106256046315_200000210301 [0,0,1,0,0,0|2,0,0]=3 719 B8R0.7 CCCCCCN(C)C 269982a_100102631434_100000210757 [0,0,1,0,0,0|2,0,0]=3 720 B8R0.7 CCCCCCN(C)C 269982a_106256046315_200000210301 [0,0,1,0,0,0|2,0,0]=3 721 B8R0.7 CCCCCCN(C)[13CH3] 2230a_106256046315_200025704644 [0,0,1,0,0,0|2,0,0]=3 722 B8R0.7 CCCCCCN(C)[13CH3] 269982a_106256046315_200025704644 [0,0,1,0,0,0|2,0,0]=3 723 B8R0.7 CCCCOCN(C)C 2230a_100102631434_100011995733 [0,0,1,0,0,0|3,0,0]=4 724 B8R0.7 CCCCOCN(C)C 269982a_100102631434_100011995733 [0,0,1,0,0,0|3,0,0]=4 725 B8R0.7 CCCNCC=C(C)C 34a_100000718196_100000210303 [0,0,1,0,0,0|2,0,1]=4 726 B8R0.7 CCCNCCC(C)C 269862a_100020643023_100000185833 [0,0,1,0,0,0|2,0,0]=3 727 B8R0.7 CCCNCCC(C)O 2230a_200000755665_100000210303 [0,0,1,0,0,0|3,0,0]=4 728 B8R0.7 CCCOCCC(C)C 34a_100000210254_100000210303 [0,0,1,0,0,0|3,0,0]=4 729 B8R0.7 CCCOCCC(C)C 34a_100000210258_100000210312 [0,0,1,0,0,0|3,0,0]=4 730 B8R0.7 CCCOCCC(C)C 7a_100000210254_100000210303 [0,0,1,0,0,0|3,0,0]=4 731 B8R0.7 CCCOCCN(C)C 2230a_100102631434_100011215938 [0,0,1,0,0,0|2,0,0]=3 732 B8R0.7 CCCOCCN(C)C 269982a_100102631434_100011215938 [0,0,1,0,0,0|2,0,0]=3 733 B8R0.7 CCCSCCC(C)C 62a_100000210303_100000210312 [0,0,1,0,0,0|3,0,0]=4 734 B8R0.7 CCCSCCC(C)C 62a_100000210312_100000210303 [0,0,1,0,0,0|3,0,0]=4 735 B8R0.7 CCCSCCN(C)C 62a_100000210303_100000755713 [0,0,1,0,0,0|2,0,0]=3 736 B8R0.7 CCOCCCN(C)C 2230a_100102631434_100012232248 [0,0,1,0,0,0|3,0,0]=4 737 B8R0.7 CCOCCCN(C)C 269982a_100102631434_100012232248 [0,0,1,0,0,0|3,0,0]=4 738 B8R0.7 CCSCCCN(C)C 62a_100000210202_100000757444 [0,0,1,0,0,0|3,0,0]=4 739 B8R0.7 CN(C)CCCCC#N 2230a_100102631434_100000211819 [0,0,1,0,0,0|1,0,2]=4 740 B8R0.7 CN(C)CCCCC#N 269982a_100102631434_100011219923 [0,0,1,0,0,0|1,0,2]=4 741 B8R0.7 CN(C)CCCCC=O 2230a_100102631434_100000139335 [0,0,1,0,0,0|2,0,1]=4 742 B8R0.7 CN(C)CCCCC=O 269982a_100102631434_100000139335 [0,0,1,0,0,0|2,0,1]=4 743 B8R0.7 CN(C)CCCCCF 2230a_100102631434_100000729378 [0,0,1,0,0,0|2,0,0]=3 744 B8R0.7 CN(C)CCCCCF 269982a_100102631434_100000729378 [0,0,1,0,0,0|2,0,0]=3 745 B8R0.7 CN(C)CCCCCO 2230a_100000722520_200000210301 [0,0,1,0,0,0|2,0,0]=3 746 B8R0.7 CN(C)CCCCCO 2230a_100102631434_100000746330 [0,0,1,0,0,0|2,0,0]=3 747 B8R0.7 CN(C)CCCCCO 269982a_100000722520_200000210301 [0,0,1,0,0,0|2,0,0]=3 748 B8R0.7 CN(C)CCCCCO 269982a_100102631434_100000746330 [0,0,1,0,0,0|2,0,0]=3 749 B8R0.7 CN(C)CCCCS[13CH3] 62a_200025704644_100000690147 [0,0,1,0,0,0|3,0,0]=4 750 B8R0.7 CN(C)CCCSCF 62a_100015361967_100000757444 [0,0,1,0,0,0|3,0,0]=4 751 B8R0.7 CN(C)CCOCC#N 2230a_100102631434_200000047693 [0,0,1,0,0,0|1,0,2]=4 752 B8R0.7 CN(C)CCOCCO 2230a_100000228057_200000210301 [0,0,1,0,0,0|2,0,0]=3 753 B8R0.7 CN(C)CCOCCO 2230a_100102631434_100011215305 [0,0,1,0,0,0|2,0,0]=3 754 B8R0.7 CN(C)CCOCCO 269982a_100000228057_200000210301 [0,0,1,0,0,0|2,0,0]=3 755 B8R0.7 CN(C)CCOCCO 269982a_100102631434_100011215305 [0,0,1,0,0,0|2,0,0]=3 756 B8R0.7 CN(C)CCSCC#N 62a_100011215382_100000755713 [0,0,1,0,0,0|1,0,2]=4 757 B8R0.7 CN(C)CCSCC=O 62a_200015260668_100000755713 [0,0,1,0,0,0|2,0,1]=4 758 B8R0.7 CN(C)CCSCCF 62a_100011217306_100000755713 [0,0,1,0,0,0|2,0,0]=3 759 B8R0.7 CN(C)CCSCCO 62a_100000211926_100000755713 [0,0,1,0,0,0|2,0,0]=3 760 B8R0.7 CN([13CH3])CCCCCO 2230a_100000722520_200025704644 [0,0,1,0,0,0|2,0,0]=3 761 B8R0.7 CN([13CH3])CCCCCO 269982a_100000722520_200025704644 [0,0,1,0,0,0|2,0,0]=3 762 B8R0.7 CN([13CH3])CCOCCO 2230a_100000228057_200025704644 [0,0,1,0,0,0|2,0,0]=3 763 B8R0.7 CN([13CH3])CCOCCO 269982a_100000228057_200025704644 [0,0,1,0,0,0|2,0,0]=3 764 B8R0.7 COCCCCN(C)C 2230a_100102631434_100000730899 [0,0,1,0,0,0|3,0,0]=4 765 B8R0.7 COCCCCN(C)C 269982a_100102631434_100000730899 [0,0,1,0,0,0|3,0,0]=4 766 B8R0.7 COCSCCN(C)C 62a_100000766300_100000755713 [0,0,1,0,0,0|3,0,0]=4 767 B8R0.7 CSCCCCN(C)C 62a_200000210301_100000690147 [0,0,1,0,0,0|3,0,0]=4 768 B8R0.7 CSCSCCN(C)C 62a_100011218213_100000755713 [0,0,1,0,0,0|3,0,0]=4 769 B10R2.410 C(CC1CC1)NC2CC2 34a_100000212008_100000694398 [0,0,0,1,0,0|2,0,0]=3 770 B10R2.410 C(CC1CC1)NC2CC2 34a_100000764129_100000211595 [0,0,0,1,0,0|2,0,0]=3 771 B10R2.410 C(CC1CC1)OC2CC2 34a_100000754188_100000211595 [0,0,0,1,0,0|3,0,0]=4 772 B10R2.410 C(CC1CC1)SC2CC2 62a_100000764125_100000211595 [0,0,0,1,0,0|3,0,0]=4 773 B10R2.410 C(CC1CO1)NC2CC2 34a_100000212008_100000732470 [0,0,0,1,0,0|3,0,0]=4 774 B10R2.411 C1CN(C1)CCC2CC2 269982a_100000754969_100000694398 [0,0,0,1,0,0|2,0,0]=3 775 B10R2.411 C1CN(C1)CCC2CO2 269982a_100000754969_100000732470 [0,0,0,1,0,0|3,0,0]=4 776 B10R1.57 C#CCCCCN1CCC1 269982a_100000754969_100010269958 [0,0,0,0,0,1|2,0,1]=4 777 B10R1.57 C=CCCCCN1CCC1 269982a_100000754969_100011215482 [0,0,0,0,0,1|2,0,1]=4 778 B10R1.57 CC/C=C\CCN1CCC1 269982a_100000754969_100015370543 [0,0,0,0,0,1|2,0,1]=4 779 B10R1.57 CCCCCCN1CCC1 269982a_100000754969_100000210757 [0,0,0,0,0,1|2,0,0]=3 780 B10R1.57 CCCCOCN1CCC1 269982a_100000754969_100011995733 [0,0,0,0,0,1|3,0,0]=4 781 B10R1.57 CCCOCCC1COC1 34a_100009855314_100000210303 [0,0,0,0,0,1|3,0,0]=4 782 B10R1.57 CCCOCCN1CCC1 269982a_100000754969_100011215938 [0,0,0,0,0,1|2,0,0]=3 783 B10R1.57 CCOCCCN1CCC1 269982a_100000754969_100012232248 [0,0,0,0,0,1|3,0,0]=4 784 B10R1.57 COCCCCN1CCC1 269982a_100000754969_100000730899 [0,0,0,0,0,1|3,0,0]=4 785 B10R1.57 FCCCCCN1CCC1 269982a_100000754969_100000729378 [0,0,0,0,0,1|2,0,0]=3 786 B10R1.57 FCCOCCC1COC1 34a_100009855314_100011217306 [0,0,0,0,0,1|3,0,0]=4 787 B10R1.57 N#CCCCCN1CCC1 269982a_100000754969_100011219923 [0,0,0,0,0,1|1,0,2]=4 788 B10R1.57 NCCCCOC1CCC1 34a_100000750430_100000749161 [0,0,0,0,0,1|3,0,0]=4 789 B10R1.57 NCCCCOC1COC1 34a_100000750430_100009818527 [0,0,0,0,0,1|3,0,0]=4 790 B10R1.57 NCCCOCC1CCC1 34a_100000182051_100000763275 [0,0,0,0,0,1|3,0,0]=4 791 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [0,0,0,0,0,1|3,0,0]=4 792 B10R1.57 NCCCOCC1COC1 34a_100000182051_100010264016 [0,0,0,0,0,1|3,0,0]=4 793 B10R1.57 O=CCCCCN1CCC1 269982a_100000754969_100000139335 [0,0,0,0,0,1|2,0,1]=4 794 B10R1.57 OCCCCCN1CCC1 269982a_100000754969_100000746330 [0,0,0,0,0,1|2,0,0]=3 795 B10R1.57 OCCOCCC1COC1 34a_100009855314_100000211926 [0,0,0,0,0,1|3,0,0]=4 796 B10R1.57 OCCOCCN1CCC1 269982a_100000754969_100011215305 [0,0,0,0,0,1|2,0,0]=3 797 B7R0.1 C#CCCCNCC 2230a_100015525214_100000731252 [1,0,1,0,0,0|1,0,1]=4 798 B7R0.1 C#CCCCNCC 34a_100000718082_100000210202 [1,0,1,0,0,0|1,0,1]=4 799 B7R0.1 C#CCNCCCC 2230a_100000102301_100000038162 [1,0,1,0,0,0|1,0,1]=4 800 B7R0.1 C#CCNCCCC 34a_100000212058_100000210210 [1,0,1,0,0,0|1,0,1]=4 801 B7R0.1 C#CCNCCCC 7a_106832991798_100000038162 [1,0,1,0,0,0|1,0,1]=4 802 B7R0.1 C=CCCCNCC 2230a_100000700776_100000210202 [1,0,1,0,0,0|1,0,1]=4 803 B7R0.1 C=CCCCNCC 2230a_100015525214_100011713584 [1,0,1,0,0,0|1,0,1]=4 804 B7R0.1 C=CCCCNCC 34a_100000700776_100000210202 [1,0,1,0,0,0|1,0,1]=4 805 B7R0.1 C=CCNCCCC 2230a_100000102301_100000210623 [1,0,1,0,0,0|1,0,1]=4 806 B7R0.1 C=CCNCCCC 2230a_100020586998_100000210211 [1,0,1,0,0,0|1,0,1]=4 807 B7R0.1 C=CCNCCCC 7a_106832991798_100015514636 [1,0,1,0,0,0|1,0,1]=4 808 B7R0.1 CC/C=C\CNCC 2230a_100015525214_100103147603 [1,0,1,0,0,0|1,0,1]=4 809 B7R0.1 CCC#CCNCC 2230a_100015525214_100009813939 [1,0,1,0,0,0|1,0,1]=4 810 B7R0.1 CCCCCCNC 2230a_100000210581_200000210301 [1,0,1,0,0,0|2,0,0]=4 811 B7R0.1 CCCCCCNC 2230a_106832991635_100000210314 [1,0,1,0,0,0|2,0,0]=4 812 B7R0.1 CCCCCCNC 34a_100102657272_100000210314 [1,0,1,0,0,0|2,0,0]=4 813 B7R0.1 CCCCCCNC 7a_106832991635_100000210314 [1,0,1,0,0,0|2,0,0]=4 814 B7R0.1 CCCCCCN[13CH3] 2230a_100000210581_200025704644 [1,0,1,0,0,0|2,0,0]=4 815 B7R0.1 CCCCCNCC 2230a_100000209983_100000210202 [1,0,1,0,0,0|1,0,0]=3 816 B7R0.1 CCCCCNCC 2230a_100015525214_100000210326 [1,0,1,0,0,0|1,0,0]=3 817 B7R0.1 CCCCCOCC 34a_100000210253_100000210202 [1,0,1,0,0,0|2,0,0]=4 818 B7R0.1 CCCCCOCC 34a_100121572206_100000718602 [1,0,1,0,0,0|2,0,0]=4 819 B7R0.1 CCCCCOCC 7a_100000210253_100000210202 [1,0,1,0,0,0|2,0,0]=4 820 B7R0.1 CCCCCSCC 62a_100000210202_100000210326 [1,0,1,0,0,0|2,0,0]=4 821 B7R0.1 CCCCCSCC 62a_100000210326_100000210202 [1,0,1,0,0,0|2,0,0]=4 822 B7R0.1 CCCCNCC#N 2230a_100000102301_100011215382 [1,0,1,0,0,0|0,0,2]=4 823 B7R0.1 CCCCNCC#N 7a_106832991798_100011215382 [1,0,1,0,0,0|0,0,2]=4 824 B7R0.1 CCCCNCC=O 2230a_100000102301_200015260668 [1,0,1,0,0,0|1,0,1]=4 825 B7R0.1 CCCCNCC=O 7a_106832991798_200015260668 [1,0,1,0,0,0|1,0,1]=4 826 B7R0.1 CCCCNCCC 2230a_100000102301_100000210303 [1,0,1,0,0,0|1,0,0]=3 827 B7R0.1 CCCCNCCC 7a_106832991798_100000210303 [1,0,1,0,0,0|1,0,0]=3 828 B7R0.1 CCCCNCCF 2230a_100000102301_100011217306 [1,0,1,0,0,0|1,0,0]=3 829 B7R0.1 CCCCNCCF 34a_100000724931_100000210210 [1,0,1,0,0,0|1,0,0]=3 830 B7R0.1 CCCCNCCF 7a_106832991798_100011217306 [1,0,1,0,0,0|1,0,0]=3 831 B7R0.1 CCCCNCCO 2230a_100000102301_100000211926 [1,0,1,0,0,0|1,0,0]=3 832 B7R0.1 CCCCNCCO 2230a_100016997473_100000210211 [1,0,1,0,0,0|1,0,0]=3 833 B7R0.1 CCCCNCCO 34a_100016990907_100000210210 [1,0,1,0,0,0|1,0,0]=3 834 B7R0.1 CCCCNCCO 7a_106832991798_100000211926 [1,0,1,0,0,0|1,0,0]=3 835 B7R0.1 CCCCNCOC 2230a_100000102301_100000766300 [1,0,1,0,0,0|2,0,0]=4 836 B7R0.1 CCCCNCSC 2230a_100000102301_100011218213 [1,0,1,0,0,0|2,0,0]=4 837 B7R0.1 CCCCOCCBr 34a_100000211926_100000210210 [1,0,1,0,0,0|2,0,0]=4 838 B7R0.1 CCCCOCCC 34a_100000210227_100000210303 [1,0,1,0,0,0|2,0,0]=4 839 B7R0.1 CCCCOCCC 34a_100000210258_100000210210 [1,0,1,0,0,0|2,0,0]=4 840 B7R0.1 CCCCOCCC 7a_100000210227_100000210303 [1,0,1,0,0,0|2,0,0]=4 841 B7R0.1 CCCCOCCF 34a_100000210227_100011217306 [1,0,1,0,0,0|2,0,0]=4 842 B7R0.1 CCCCOCCF 7a_100000210227_100011217306 [1,0,1,0,0,0|2,0,0]=4 843 B7R0.1 CCCCOCCN 34a_100000210304_100000210210 [1,0,1,0,0,0|1,0,0]=3 844 B7R0.1 CCCCOCCO 34a_100000210227_100000211926 [1,0,1,0,0,0|2,0,0]=4 845 B7R0.1 CCCCOCCO 7a_100000210227_100000211926 [1,0,1,0,0,0|2,0,0]=4 846 B7R0.1 CCCCSCCC 62a_100000210211_100000210303 [1,0,1,0,0,0|2,0,0]=4 847 B7R0.1 CCCCSCCC 62a_100000210303_100000210210 [1,0,1,0,0,0|2,0,0]=4 848 B7R0.1 CCCCSCCF 62a_100000210211_100011217306 [1,0,1,0,0,0|2,0,0]=4 849 B7R0.1 CCCCSCCF 62a_100011217306_100000210210 [1,0,1,0,0,0|2,0,0]=4 850 B7R0.1 CCCCSCCO 62a_100000210211_100000211926 [1,0,1,0,0,0|2,0,0]=4 851 B7R0.1 CCCCSCCO 62a_100000211926_100000210210 [1,0,1,0,0,0|2,0,0]=4 852 B7R0.1 CCCNCCCF 2230a_100015189416_100000210303 [1,0,1,0,0,0|2,0,0]=4 853 B7R0.1 CCCNCCCF 34a_100015189416_100000210303 [1,0,1,0,0,0|2,0,0]=4 854 B7R0.1 CCCNCCOC 2230a_100000209980_100000210303 [1,0,1,0,0,0|2,0,0]=4 855 B7R0.1 CCCNCCSC 2230a_100020590264_100000210303 [1,0,1,0,0,0|2,0,0]=4 856 B7R0.1 CCCOCCCN 34a_100000182051_100000210303 [1,0,1,0,0,0|2,0,0]=4 857 B7R0.1 CCCOCCNC 2230a_100161115042_200000210301 [1,0,1,0,0,0|2,0,0]=4 858 B7R0.1 CCCOCCNC 2230a_106832991635_100011215938 [1,0,1,0,0,0|2,0,0]=4 859 B7R0.1 CCCOCCNC 34a_100102657272_100011215938 [1,0,1,0,0,0|2,0,0]=4 860 B7R0.1 CCCOCCNC 34a_100161115042_200000210301 [1,0,1,0,0,0|2,0,0]=4 861 B7R0.1 CCCOCCNC 7a_106832991635_100011215938 [1,0,1,0,0,0|2,0,0]=4 862 B7R0.1 CCCOCCN[13CH3] 2230a_100161115042_200025704644 [1,0,1,0,0,0|2,0,0]=4 863 B7R0.1 CCCOCCN[13CH3] 34a_100161115042_200025704644 [1,0,1,0,0,0|2,0,0]=4 864 B7R0.1 CCCSCCNC 2230a_100020603323_200000210301 [1,0,1,0,0,0|2,0,0]=4 865 B7R0.1 CCCSCCN[13CH3] 2230a_100020603323_200025704644 [1,0,1,0,0,0|2,0,0]=4 866 B7R0.1 CCNCCCC#N 2230a_100015525214_100000687738 [1,0,1,0,0,0|0,0,2]=4 867 B7R0.1 CCNCCCC=O 2230a_100015525214_200011292268 [1,0,1,0,0,0|1,0,1]=4 868 B7R0.1 CCNCCCCF 2230a_100015525214_100000729493 [1,0,1,0,0,0|1,0,0]=3 869 B7R0.1 CCNCCCCO 2230a_100000750430_100000210202 [1,0,1,0,0,0|1,0,0]=3 870 B7R0.1 CCNCCCCO 2230a_100015525214_100000210776 [1,0,1,0,0,0|1,0,0]=3 871 B7R0.1 CCNCCCCO 34a_100000750430_100000210202 [1,0,1,0,0,0|1,0,0]=3 872 B7R0.1 CCNCCCOC 2230a_100015525214_100000740836 [1,0,1,0,0,0|2,0,0]=4 873 B7R0.1 CCNCCCOC 34a_100150723488_100000210202 [1,0,1,0,0,0|2,0,0]=4 874 B7R0.1 CCNCCCSC 2230a_100000749238_100000210202 [1,0,1,0,0,0|2,0,0]=4 875 B7R0.1 CCNCCOCC 2230a_100015525214_100011215890 [1,0,1,0,0,0|1,0,0]=3 876 B7R0.1 CCNCCOCC 2230a_102516460346_100000210202 [1,0,1,0,0,0|1,0,0]=3 877 B7R0.1 CCNCCOCC 34a_102516460346_100000210202 [1,0,1,0,0,0|1,0,0]=3 878 B7R0.1 CCNCCSCC 2230a_100000106463_100000210202 [1,0,1,0,0,0|1,0,0]=3 879 B7R0.1 CCNCCSCC 2230a_100015525214_100000757381 [1,0,1,0,0,0|1,0,0]=3 880 B7R0.1 CCOCCCCBr 34a_100011216708_100000210202 [1,0,1,0,0,0|2,0,0]=4 881 B7R0.1 CCOCCCCCl 34a_100000210776_100000210202 [1,0,1,0,0,0|2,0,0]=4 882 B7R0.1 CCOCCCCCl 7a_100000210776_100000210202 [1,0,1,0,0,0|2,0,0]=4 883 B7R0.1 CCOCCCCF 34a_100011995726_100000210202 [1,0,1,0,0,0|2,0,0]=4 884 B7R0.1 CCOCCCCF 34a_100121572206_100000729493 [1,0,1,0,0,0|2,0,0]=4 885 B7R0.1 CCOCCCCF 7a_100011995726_100000210202 [1,0,1,0,0,0|2,0,0]=4 886 B7R0.1 CCOCCCCI 34a_200012148704_100000210202 [1,0,1,0,0,0|2,0,0]=4 887 B7R0.1 CCOCCCCN 34a_100000750430_100000210202 [1,0,1,0,0,0|1,0,0]=3 888 B7R0.1 CCOCCCCO 34a_100121572206_100011216708 [1,0,1,0,0,0|2,0,0]=4 889 B7R0.1 CCOCCNCF 34a_102516460346_100015361967 [1,0,1,0,0,0|2,0,0]=4 890 B7R0.1 CCOCCOCC 34a_100000210136_100000210202 [1,0,1,0,0,0|2,0,0]=4 891 B7R0.1 CCOCCOCC 34a_100121572206_100000210147 [1,0,1,0,0,0|2,0,0]=4 892 B7R0.1 CCOCCOCC 7a_100000210136_100000210202 [1,0,1,0,0,0|2,0,0]=4 893 B7R0.1 CCOCCSCC 34a_100000212035_100000210202 [1,0,1,0,0,0|2,0,0]=4 894 B7R0.1 CCOCCSCC 34a_100121572206_100000757381 [1,0,1,0,0,0|2,0,0]=4 895 B7R0.1 CCOCCSCC 62a_100000210147_100000210202 [1,0,1,0,0,0|2,0,0]=4 896 B7R0.1 CCOCCSCC 62a_100000210202_100011215890 [1,0,1,0,0,0|2,0,0]=4 897 B7R0.1 CCOCCSCC 7a_100000212035_100000210202 [1,0,1,0,0,0|2,0,0]=4 898 B7R0.1 CCSCCCCF 62a_100000210202_100000729493 [1,0,1,0,0,0|2,0,0]=4 899 B7R0.1 CCSCCCCF 62a_100000729493_100000210202 [1,0,1,0,0,0|2,0,0]=4 900 B7R0.1 CCSCCCCO 62a_100000210202_100000210776 [1,0,1,0,0,0|2,0,0]=4 901 B7R0.1 CCSCCCCO 62a_100000210776_100000210202 [1,0,1,0,0,0|2,0,0]=4 902 B7R0.1 CCSCCSCC 62a_100000210202_100000757381 [1,0,1,0,0,0|2,0,0]=4 903 B7R0.1 CCSCCSCC 62a_100000757381_100000210202 [1,0,1,0,0,0|2,0,0]=4 904 B7R0.1 CNCCCCCF 2230a_106832991635_100000729378 [1,0,1,0,0,0|2,0,0]=4 905 B7R0.1 CNCCCCCF 34a_100102657272_100000729378 [1,0,1,0,0,0|2,0,0]=4 906 B7R0.1 CNCCCCCF 7a_106832991635_100000729378 [1,0,1,0,0,0|2,0,0]=4 907 B7R0.1 CNCCCCCO 2230a_100000762737_200000210301 [1,0,1,0,0,0|2,0,0]=4 908 B7R0.1 CNCCCCCO 2230a_106832991635_100000746330 [1,0,1,0,0,0|2,0,0]=4 909 B7R0.1 CNCCCCCO 34a_100000762737_200000210301 [1,0,1,0,0,0|2,0,0]=4 910 B7R0.1 CNCCCCCO 34a_100102657272_100000746330 [1,0,1,0,0,0|2,0,0]=4 911 B7R0.1 CNCCCCCO 7a_106832991635_100000746330 [1,0,1,0,0,0|2,0,0]=4 912 B7R0.1 CNCCOCCO 2230a_100000211614_200000210301 [1,0,1,0,0,0|2,0,0]=4 913 B7R0.1 CNCCOCCO 2230a_106832991635_100011215305 [1,0,1,0,0,0|2,0,0]=4 914 B7R0.1 CNCCOCCO 34a_100000211614_200000210301 [1,0,1,0,0,0|2,0,0]=4 915 B7R0.1 CNCCOCCO 34a_100102657272_100000692535 [1,0,1,0,0,0|2,0,0]=4 916 B7R0.1 CNCCOCCO 7a_106832991635_100011215305 [1,0,1,0,0,0|2,0,0]=4 917 B7R0.1 CNCCSCCO 2230a_100011219999_200000210301 [1,0,1,0,0,0|2,0,0]=4 918 B7R0.1 COCCCCCN 34a_100000762737_200000210301 [1,0,1,0,0,0|2,0,0]=4 919 B7R0.1 COCCNCCF 2230a_100000209980_100011217306 [1,0,1,0,0,0|2,0,0]=4 920 B7R0.1 COCCNCCF 34a_100000724931_100011201679 [1,0,1,0,0,0|2,0,0]=4 921 B7R0.1 COCCNCCO 2230a_100000209980_100000211926 [1,0,1,0,0,0|2,0,0]=4 922 B7R0.1 COCCNCCO 2230a_100016997473_100011201679 [1,0,1,0,0,0|2,0,0]=4 923 B7R0.1 COCCNCCO 34a_100016990907_100011201679 [1,0,1,0,0,0|2,0,0]=4 924 B7R0.1 COCCOCCN 34a_100000210304_100011201679 [1,0,1,0,0,0|2,0,0]=4 925 B7R0.1 COCCOCCN 34a_100000211614_200000210301 [1,0,1,0,0,0|2,0,0]=4 926 B7R0.1 CSCCNCCF 2230a_100020590264_100011217306 [1,0,1,0,0,0|2,0,0]=4 927 B7R0.1 CSCCNCCF 34a_100000724931_100000212216 [1,0,1,0,0,0|2,0,0]=4 928 B7R0.1 CSCCNCCO 2230a_100016997473_100000751147 [1,0,1,0,0,0|2,0,0]=4 929 B7R0.1 CSCCNCCO 2230a_100020590264_100000211926 [1,0,1,0,0,0|2,0,0]=4 930 B7R0.1 CSCCNCCO 34a_100016990907_100000212216 [1,0,1,0,0,0|2,0,0]=4 931 B7R0.1 CSCCOCCN 34a_100000210304_100000212216 [1,0,1,0,0,0|2,0,0]=4 932 B7R0.1 FCCCNCCF 2230a_100015189416_100011217306 [1,0,1,0,0,0|2,0,0]=4 933 B7R0.1 FCCCNCCF 34a_100000724931_100011934791 [1,0,1,0,0,0|2,0,0]=4 934 B7R0.1 FCCCNCCF 34a_100015189416_100011217306 [1,0,1,0,0,0|2,0,0]=4 935 B7R0.1 NCCCCOCF 34a_100000750430_100015361967 [1,0,1,0,0,0|2,0,0]=4 936 B7R0.1 NCCOCCCF 34a_100000210304_100011934791 [1,0,1,0,0,0|2,0,0]=4 937 B7R0.1 NCCOCCCO 34a_100000210304_100000230001 [1,0,1,0,0,0|2,0,0]=4 938 B7R0.1 OCCCCNCF 34a_100000750430_100015361967 [1,0,1,0,0,0|2,0,0]=4 939 B7R0.1 OCCCNCCF 34a_100000724931_100000230001 [1,0,1,0,0,0|2,0,0]=4 940 B7R0.1 OCCCNCCO 2230a_100016997473_100000230001 [1,0,1,0,0,0|2,0,0]=4 941 B7R0.1 OCCCNCCO 34a_100016990907_100000230001 [1,0,1,0,0,0|2,0,0]=4 942 B7R0.1 OCCNCCCF 2230a_100015189416_100000211926 [1,0,1,0,0,0|2,0,0]=4 943 B7R0.1 OCCNCCCF 2230a_100016997473_100011934791 [1,0,1,0,0,0|2,0,0]=4 944 B7R0.1 OCCNCCCF 34a_100015189416_100000211926 [1,0,1,0,0,0|2,0,0]=4 945 B7R0.1 OCCNCCCF 34a_100016990907_100011934791 [1,0,1,0,0,0|2,0,0]=4 946 B7R0.1 [13CH3]NCCCCCO 2230a_100000762737_200025704644 [1,0,1,0,0,0|2,0,0]=4 947 B7R0.1 [13CH3]NCCCCCO 34a_100000762737_200025704644 [1,0,1,0,0,0|2,0,0]=4 948 B7R0.1 [13CH3]NCCOCCO 2230a_100000211614_200025704644 [1,0,1,0,0,0|2,0,0]=4 949 B7R0.1 [13CH3]NCCOCCO 34a_100000211614_200025704644 [1,0,1,0,0,0|2,0,0]=4 950 B7R0.1 [13CH3]NCCSCCO 2230a_100011219999_200025704644 [1,0,1,0,0,0|2,0,0]=4 951 B7R0.1 [13CH3]OCCCCCN 34a_100000762737_200025704644 [1,0,1,0,0,0|2,0,0]=4 952 B7R0.1 [13CH3]OCCOCCN 34a_100000211614_200025704644 [1,0,1,0,0,0|2,0,0]=4 953 B7R0.4 C#CCCCN(C)C 2230a_100102631434_100000731252 [1,0,1,0,0,0|1,0,1]=4 954 B7R0.4 C#CCCCN(C)C 269982a_100102631434_100011215417 [1,0,1,0,0,0|1,0,1]=4 955 B7R0.4 C=C(C)CCNCC 2230a_100015525214_100000730704 [1,0,1,0,0,0|1,0,1]=4 956 B7R0.4 C=CCCCN(C)C 2230a_100102631434_100011713584 [1,0,1,0,0,0|1,0,1]=4 957 B7R0.4 C=CCCCN(C)C 269982a_100102631434_100000757094 [1,0,1,0,0,0|1,0,1]=4 958 B7R0.4 CC(C)CNCCF 2230a_100000210953_100011217306 [1,0,1,0,0,0|2,0,0]=4 959 B7R0.4 CC(C)CNCCF 34a_100000210953_100011217306 [1,0,1,0,0,0|2,0,0]=4 960 B7R0.4 CC(C)CNCCF 34a_100000724931_100000210624 [1,0,1,0,0,0|2,0,0]=4 961 B7R0.4 CC(C)CNCCO 2230a_100000210953_100000211926 [1,0,1,0,0,0|2,0,0]=4 962 B7R0.4 CC(C)CNCCO 2230a_100016997473_100000210760 [1,0,1,0,0,0|2,0,0]=4 963 B7R0.4 CC(C)CNCCO 270004a_100000210304_100000210432 [1,0,1,0,0,0|2,0,0]=4 964 B7R0.4 CC(C)CNCCO 34a_100000210953_100000211926 [1,0,1,0,0,0|2,0,0]=4 965 B7R0.4 CC(C)CNCCO 34a_100016990907_100000210624 [1,0,1,0,0,0|2,0,0]=4 966 B7R0.4 CC(C)COCCN 34a_100000210304_100000210624 [1,0,1,0,0,0|2,0,0]=4 967 B7R0.4 CC(C)OCCCN 34a_100000182051_100000210206 [1,0,1,0,0,0|2,0,0]=4 968 B7R0.4 CC/C=C\CN(C)C 2230a_100102631434_100103147603 [1,0,1,0,0,0|1,0,1]=4 969 B7R0.4 CC/C=C\CN(C)C 269982a_100102631434_100103147603 [1,0,1,0,0,0|1,0,1]=4 970 B7R0.4 CCC#CCN(C)C 2230a_100102631434_100009813939 [1,0,1,0,0,0|1,0,1]=4 971 B7R0.4 CCCCCN(C)C 2230a_100000223495_200000210301 [1,0,1,0,0,0|1,0,0]=3 972 B7R0.4 CCCCCN(C)C 2230a_100102631434_100000210326 [1,0,1,0,0,0|1,0,0]=3 973 B7R0.4 CCCCCN(C)C 269982a_100000223495_200000210301 [1,0,1,0,0,0|1,0,0]=3 974 B7R0.4 CCCCCN(C)C 269982a_100102631434_100000210215 [1,0,1,0,0,0|1,0,0]=3 975 B7R0.4 CCCCCN(C)[13CH3] 2230a_100000223495_200025704644 [1,0,1,0,0,0|1,0,0]=3 976 B7R0.4 CCCCCN(C)[13CH3] 269982a_100000223495_200025704644 [1,0,1,0,0,0|1,0,0]=3 977 B7R0.4 CCCNCC(C)C 2230a_100000210953_100000210303 [1,0,1,0,0,0|2,0,0]=4 978 B7R0.4 CCCNCC(C)C 270004a_100020643023_100000210432 [1,0,1,0,0,0|2,0,0]=4 979 B7R0.4 CCCNCC(C)C 34a_100000210953_100000210303 [1,0,1,0,0,0|2,0,0]=4 980 B7R0.4 CCNCC=C(C)C 2230a_100015525214_100000761012 [1,0,1,0,0,0|1,0,1]=4 981 B7R0.4 CCNCC=C(C)C 34a_100000718196_100000210202 [1,0,1,0,0,0|1,0,1]=4 982 B7R0.4 CCNCCC(C)C 2230a_100015525214_100000210312 [1,0,1,0,0,0|1,0,0]=3 983 B7R0.4 CCNCCC(C)C 269862a_100015525214_100000185833 [1,0,1,0,0,0|1,0,0]=3 984 B7R0.4 CCNCCC(C)O 2230a_100015525214_100012276601 [1,0,1,0,0,0|2,0,0]=4 985 B7R0.4 CCNCCC(C)O 2230a_200000755665_100000210202 [1,0,1,0,0,0|2,0,0]=4 986 B7R0.4 CCNCOC(C)C 2230a_100015525214_100000709892 [1,0,1,0,0,0|2,0,0]=4 987 B7R0.4 CCOCCC(C)C 34a_100000210254_100000210202 [1,0,1,0,0,0|2,0,0]=4 988 B7R0.4 CCOCCC(C)C 34a_100121572206_100000210312 [1,0,1,0,0,0|2,0,0]=4 989 B7R0.4 CCOCCC(C)C 7a_100000210254_100000210202 [1,0,1,0,0,0|2,0,0]=4 990 B7R0.4 CCOCCN(C)C 2230a_100102631434_100011215890 [1,0,1,0,0,0|1,0,0]=3 991 B7R0.4 CCOCCN(C)C 269982a_100102631434_100011215890 [1,0,1,0,0,0|1,0,0]=3 992 B7R0.4 CCSCCC(C)C 62a_100000210202_100000210312 [1,0,1,0,0,0|2,0,0]=4 993 B7R0.4 CCSCCC(C)C 62a_100000210312_100000210202 [1,0,1,0,0,0|2,0,0]=4 994 B7R0.4 CCSCCN(C)C 2230a_100102631434_100000757381 [1,0,1,0,0,0|1,0,0]=3 995 B7R0.4 CCSCCN(C)C 269982a_100102631434_100000757381 [1,0,1,0,0,0|1,0,0]=3 996 B7R0.4 CCSCCN(C)C 62a_100000210202_100000755713 [1,0,1,0,0,0|1,0,0]=3 997 B7R0.4 CN(C)CCCC#N 2230a_100102631434_100000687738 [1,0,1,0,0,0|0,0,2]=4 998 B7R0.4 CN(C)CCCC#N 269982a_100102631434_100000687738 [1,0,1,0,0,0|0,0,2]=4 999 B7R0.4 CN(C)CCCC=O 2230a_100102631434_200011292268 [1,0,1,0,0,0|1,0,1]=4 1000 B7R0.4 CN(C)CCCC=O 269982a_100102631434_200011292268 [1,0,1,0,0,0|1,0,1]=4 1001 B7R0.4 CN(C)CCCCF 2230a_100102631434_100000729493 [1,0,1,0,0,0|1,0,0]=3 1002 B7R0.4 CN(C)CCCCF 269982a_100102631434_100000729493 [1,0,1,0,0,0|1,0,0]=3 1003 B7R0.4 CN(C)CCCCO 2230a_100000717598_200000210301 [1,0,1,0,0,0|1,0,0]=3 1004 B7R0.4 CN(C)CCCCO 2230a_100102631434_100000210776 [1,0,1,0,0,0|1,0,0]=3 1005 B7R0.4 CN(C)CCCCO 269982a_100000717598_200000210301 [1,0,1,0,0,0|1,0,0]=3 1006 B7R0.4 CN(C)CCCCO 269982a_100102631434_100000210776 [1,0,1,0,0,0|1,0,0]=3 1007 B7R0.4 CN(C)CCCS[13CH3] 62a_200025704644_100000757444 [1,0,1,0,0,0|2,0,0]=4 1008 B7R0.4 CN(C)CCSCF 62a_100015361967_100000755713 [1,0,1,0,0,0|2,0,0]=4 1009 B7R0.4 CN([13CH3])CCCCO 2230a_100000717598_200025704644 [1,0,1,0,0,0|1,0,0]=3 1010 B7R0.4 CN([13CH3])CCCCO 269982a_100000717598_200025704644 [1,0,1,0,0,0|1,0,0]=3 1011 B7R0.4 CNCCCN(C)C 7a_106832991635_100000757444 [1,0,1,0,0,0|2,0,0]=4 1012 B7R0.4 COCCCN(C)C 2230a_100000224831_200000210301 [1,0,1,0,0,0|2,0,0]=4 1013 B7R0.4 COCCCN(C)C 2230a_100102631434_100000740836 [1,0,1,0,0,0|2,0,0]=4 1014 B7R0.4 COCCCN(C)C 269982a_100000224831_200000210301 [1,0,1,0,0,0|2,0,0]=4 1015 B7R0.4 COCCCN(C)C 269982a_100102631434_100000740836 [1,0,1,0,0,0|2,0,0]=4 1016 B7R0.4 COCCCN(C)[13CH3] 2230a_100000224831_200025704644 [1,0,1,0,0,0|2,0,0]=4 1017 B7R0.4 COCCCN(C)[13CH3] 269982a_100000224831_200025704644 [1,0,1,0,0,0|2,0,0]=4 1018 B7R0.4 CSCCCN(C)C 62a_200000210301_100000757444 [1,0,1,0,0,0|2,0,0]=4 1019 B7R1.7 CCCNC1CC1 34a_100000212008_100000210303 [2,0,0,0,0,0|2,0,0]=4 1020 B7R1.7 CCCOC1CC1 34a_100000210258_100000211595 [2,0,0,0,0,0|2,0,0]=4 1021 B7R1.7 CCCSC1CC1 62a_100000210303_100000211595 [2,0,0,0,0,0|2,0,0]=4 1022 B7R1.7 CCNCC1CC1 2230a_100000735609_100000210202 [2,0,0,0,0,0|1,0,0]=3 1023 B7R1.7 CCNCC1CC1 2230a_100015525214_100000742324 [2,0,0,0,0,0|1,0,0]=3 1024 B7R1.7 CCNCC1CC1 269862a_100015525214_100000741477 [2,0,0,0,0,0|1,0,0]=3 1025 B7R1.7 CCNCC1CC1 34a_100000735609_100000210202 [2,0,0,0,0,0|1,0,0]=3 1026 B7R1.7 CCNCC1CO1 2230a_100015525214_100011216344 [2,0,0,0,0,0|2,0,0]=4 1027 B7R1.7 CCOCC1CC1 34a_100000211283_100000210202 [2,0,0,0,0,0|2,0,0]=4 1028 B7R1.7 CCOCC1CC1 34a_100121572206_100000742324 [2,0,0,0,0,0|2,0,0]=4 1029 B7R1.7 CCSCC1CC1 62a_100000210202_100000742324 [2,0,0,0,0,0|2,0,0]=4 1030 B7R1.7 CCSCC1CC1 62a_100000756562_100000210202 [2,0,0,0,0,0|2,0,0]=4 1031 B7R1.7 CNCCC1CC1 2230a_106832991635_100000694398 [2,0,0,0,0,0|1,0,0]=3 1032 B7R1.7 CNCCC1CC1 34a_100000764129_200000210301 [2,0,0,0,0,0|1,0,0]=3 1033 B7R1.7 CNCCC1CC1 34a_100102657272_100000694398 [2,0,0,0,0,0|1,0,0]=3 1034 B7R1.7 CNCCC1CC1 7a_106832991635_100000764125 [2,0,0,0,0,0|1,0,0]=3 1035 B7R1.7 CNCCC1CO1 2230a_106832991635_100000732470 [2,0,0,0,0,0|2,0,0]=4 1036 B7R1.7 CNCCC1CO1 34a_100102657272_100000732470 [2,0,0,0,0,0|2,0,0]=4 1037 B7R1.7 CNCCC1CO1 7a_106832991635_100000732470 [2,0,0,0,0,0|2,0,0]=4 1038 B7R1.7 COCCC1CC1 34a_100000754188_200000210301 [2,0,0,0,0,0|2,0,0]=4 1039 B7R1.7 COCCC1CC1 34a_100138415774_100000694398 [2,0,0,0,0,0|2,0,0]=4 1040 B7R1.7 COCCC1CC1 7a_100000754188_200000210301 [2,0,0,0,0,0|2,0,0]=4 1041 B7R1.7 CSCCC1CC1 62a_100000764125_200000210301 [2,0,0,0,0,0|2,0,0]=4 1042 B7R1.7 CSCCC1CC1 62a_200000210301_100000764125 [2,0,0,0,0,0|2,0,0]=4 1043 B7R1.7 FCCNC1CC1 34a_100000212008_100011217306 [2,0,0,0,0,0|2,0,0]=4 1044 B7R1.7 FCCNC1CC1 34a_100000724931_100000211595 [2,0,0,0,0,0|2,0,0]=4 1045 B7R1.7 FCNCC1CC1 34a_100000735609_100015361967 [2,0,0,0,0,0|2,0,0]=4 1046 B7R1.7 NCCOC1CC1 34a_100000210304_100000211595 [2,0,0,0,0,0|2,0,0]=4 1047 B7R1.7 OCCNC1CC1 34a_100000212008_100000211926 [2,0,0,0,0,0|2,0,0]=4 1048 B7R1.7 OCCNC1CC1 34a_100016990907_100000211595 [2,0,0,0,0,0|2,0,0]=4 1049 B7R1.7 [13CH3]NCCC1CC1 34a_100000764129_200025704644 [2,0,0,0,0,0|1,0,0]=3 1050 B7R1.7 [13CH3]OCCC1CC1 34a_100000754188_200025704644 [2,0,0,0,0,0|2,0,0]=4 1051 B7R1.7 [13CH3]OCCC1CC1 7a_100000754188_200025704644 [2,0,0,0,0,0|2,0,0]=4 1052 B7R1.7 [13CH3]SCCC1CC1 62a_100000764125_200025704644 [2,0,0,0,0,0|2,0,0]=4 1053 B7R1.7 [13CH3]SCCC1CC1 62a_200025704644_100000764125 [2,0,0,0,0,0|2,0,0]=4 1054 B9R0.2 CC(=O)NCCNCCF 2230a_100000209853_100011217306 [0,1,1,0,0,0|1,0,1]=4 1055 B9R0.2 CC(=O)NCCNCCO 2230a_100000209853_100000211926 [0,1,1,0,0,0|1,0,1]=4 1056 B9R0.2 CC(=O)NCCNCCO 2230a_100016997473_100000189650 [0,1,1,0,0,0|1,0,1]=4 1057 B9R0.2 CC(C)CCCNCCF 2230a_200000737386_100011217306 [0,1,1,0,0,0|2,0,0]=4 1058 B9R0.2 CC(C)CCCNCCF 34a_100000724931_100011214892 [0,1,1,0,0,0|2,0,0]=4 1059 B9R0.2 CC(C)CCCNCCF 34a_200000737386_100011217306 [0,1,1,0,0,0|2,0,0]=4 1060 B9R0.2 CC(C)CCCNCCO 2230a_100016997473_100011214892 [0,1,1,0,0,0|2,0,0]=4 1061 B9R0.2 CC(C)CCCNCCO 2230a_200000737386_100000211926 [0,1,1,0,0,0|2,0,0]=4 1062 B9R0.2 CC(C)CCCNCCO 34a_100016990907_100011214892 [0,1,1,0,0,0|2,0,0]=4 1063 B9R0.2 CC(C)CCCNCCO 34a_200000737386_100000211926 [0,1,1,0,0,0|2,0,0]=4 1064 B9R0.2 CC(C)CCCOCCN 34a_100000210304_100011214892 [0,1,1,0,0,0|2,0,0]=4 1065 B9R0.2 CC(C)NCCCCCF 2230a_100138425928_100000729378 [0,1,1,0,0,0|2,0,0]=4 1066 B9R0.2 CC(C)NCCCCCF 34a_100138425928_100000729378 [0,1,1,0,0,0|2,0,0]=4 1067 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [0,1,1,0,0,0|2,0,0]=4 1068 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [0,1,1,0,0,0|2,0,0]=4 1069 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [0,1,1,0,0,0|2,0,0]=4 1070 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [0,1,1,0,0,0|2,0,0]=4 1071 B9R0.2 CC(C)NCCOCCF 34a_100000224655_100011217306 [0,1,1,0,0,0|2,0,0]=4 1072 B9R0.2 CC(C)NCCOCCO 2230a_100000211614_100000210206 [0,1,1,0,0,0|2,0,0]=4 1073 B9R0.2 CC(C)NCCOCCO 2230a_100138425928_100011215305 [0,1,1,0,0,0|2,0,0]=4 1074 B9R0.2 CC(C)NCCOCCO 34a_100000211614_100000210206 [0,1,1,0,0,0|2,0,0]=4 1075 B9R0.2 CC(C)NCCOCCO 34a_100000224655_100000211926 [0,1,1,0,0,0|2,0,0]=4 1076 B9R0.2 CC(C)NCCOCCO 34a_100138425928_100000692535 [0,1,1,0,0,0|2,0,0]=4 1077 B9R0.2 CC(C)NCCSCCO 2230a_100011219999_100000210206 [0,1,1,0,0,0|2,0,0]=4 1078 B9R0.2 CC(C)OCCCCCN 34a_100000762737_100000210206 [0,1,1,0,0,0|2,0,0]=4 1079 B9R0.2 CC(C)OCCNCCF 2230a_100000701111_100011217306 [0,1,1,0,0,0|2,0,0]=4 1080 B9R0.2 CC(C)OCCNCCF 34a_100000701111_100011217306 [0,1,1,0,0,0|2,0,0]=4 1081 B9R0.2 CC(C)OCCNCCF 34a_100000724931_100000211751 [0,1,1,0,0,0|2,0,0]=4 1082 B9R0.2 CC(C)OCCNCCO 2230a_100000701111_100000211926 [0,1,1,0,0,0|2,0,0]=4 1083 B9R0.2 CC(C)OCCNCCO 2230a_100016997473_100000211751 [0,1,1,0,0,0|2,0,0]=4 1084 B9R0.2 CC(C)OCCNCCO 34a_100000701111_100000211926 [0,1,1,0,0,0|2,0,0]=4 1085 B9R0.2 CC(C)OCCNCCO 34a_100016990907_100000211751 [0,1,1,0,0,0|2,0,0]=4 1086 B9R0.2 CC(C)OCCOCCN 34a_100000210304_100000211751 [0,1,1,0,0,0|2,0,0]=4 1087 B9R0.2 CC(C)OCCOCCN 34a_100000211614_100000210206 [0,1,1,0,0,0|2,0,0]=4 1088 B9R0.2 CC(C)SCCNCCF 2230a_100000731138_100011217306 [0,1,1,0,0,0|2,0,0]=4 1089 B9R0.2 CC(C)SCCNCCF 34a_100000724931_100000730970 [0,1,1,0,0,0|2,0,0]=4 1090 B9R0.2 CC(C)SCCNCCF 34a_100000731138_100011217306 [0,1,1,0,0,0|2,0,0]=4 1091 B9R0.2 CC(C)SCCNCCO 2230a_100000731138_100000211926 [0,1,1,0,0,0|2,0,0]=4 1092 B9R0.2 CC(C)SCCNCCO 2230a_100016997473_100000730970 [0,1,1,0,0,0|2,0,0]=4 1093 B9R0.2 CC(C)SCCNCCO 34a_100000731138_100000211926 [0,1,1,0,0,0|2,0,0]=4 1094 B9R0.2 CC(C)SCCNCCO 34a_100016990907_100000730970 [0,1,1,0,0,0|2,0,0]=4 1095 B9R0.2 CC(C)SCCOCCN 34a_100000210304_100000730970 [0,1,1,0,0,0|2,0,0]=4 1096 B9R0.2 CC(O)CCCNCCF 34a_100000724931_200000718107 [0,1,1,0,0,0|2,0,0]=4 1097 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [0,1,1,0,0,0|2,0,0]=4 1098 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [0,1,1,0,0,0|2,0,0]=4 1099 B9R0.2 CC(O)CCCOCCN 34a_100000210304_200000718107 [0,1,1,0,0,0|2,0,0]=4 1100 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [0,1,1,0,0,0|2,0,0]=4 1101 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [0,1,1,0,0,0|2,0,0]=4 1102 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [0,1,1,0,0,0|2,0,0]=4 1103 B9R0.2 CCCCCNCC(=O)N 2230a_100000209983_100000747473 [0,1,1,0,0,0|1,0,1]=4 1104 B9R0.2 CCCCCNCC(=O)N 2230a_100000711301_100000210326 [0,1,1,0,0,0|1,0,1]=4 1105 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [0,1,1,0,0,0|2,0,0]=4 1106 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [0,1,1,0,0,0|2,0,0]=4 1107 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [0,1,1,0,0,0|2,0,0]=4 1108 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [0,1,1,0,0,0|2,0,0]=4 1109 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [0,1,1,0,0,0|2,0,0]=4 1110 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [0,1,1,0,0,0|2,0,0]=4 1111 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [0,1,1,0,0,0|2,0,0]=4 1112 B9R0.2 CCCCCNCC(F)F 2230a_100000209983_100011934356 [0,1,1,0,0,0|2,0,0]=4 1113 B9R0.2 CCCCCNCC(F)F 34a_100000765723_100000718602 [0,1,1,0,0,0|2,0,0]=4 1114 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [0,1,1,0,0,0|2,0,0]=4 1115 B9R0.2 CCCCCOC[C@@H](C)N 34a_100000737577_100000718602 [0,1,1,0,0,0|2,0,0]=4 1116 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [0,1,1,0,0,0|2,0,0]=4 1117 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [0,1,1,0,0,0|2,0,0]=4 1118 B9R0.2 CCCNCCNC(=O)C 2230a_100000209853_100000210303 [0,1,1,0,0,0|1,0,1]=4 1119 B9R0.2 CCCNCCOC(C)C 2230a_100000701111_100000210303 [0,1,1,0,0,0|2,0,0]=4 1120 B9R0.2 CCCNCCOC(C)C 34a_100000701111_100000210303 [0,1,1,0,0,0|2,0,0]=4 1121 B9R0.2 CCCNCCSC(C)C 2230a_100000731138_100000210303 [0,1,1,0,0,0|2,0,0]=4 1122 B9R0.2 CCCNCCSC(C)C 34a_100000731138_100000210303 [0,1,1,0,0,0|2,0,0]=4 1123 B9R0.2 CCCOCCNC(C)C 2230a_100138425928_100011215938 [0,1,1,0,0,0|2,0,0]=4 1124 B9R0.2 CCCOCCNC(C)C 2230a_100161115042_100000210206 [0,1,1,0,0,0|2,0,0]=4 1125 B9R0.2 CCCOCCNC(C)C 34a_100000224655_100000210303 [0,1,1,0,0,0|2,0,0]=4 1126 B9R0.2 CCCOCCNC(C)C 34a_100138425928_100011215938 [0,1,1,0,0,0|2,0,0]=4 1127 B9R0.2 CCCOCCNC(C)C 34a_100161115042_100000210206 [0,1,1,0,0,0|2,0,0]=4 1128 B9R0.2 CCCSCCNC(C)C 2230a_100020603323_100000210206 [0,1,1,0,0,0|2,0,0]=4 1129 B9R0.2 CCNCCCCC(=O)N 34a_100000696515_100000210202 [0,1,1,0,0,0|1,0,1]=4 1130 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [0,1,1,0,0,0|2,0,0]=4 1131 B9R0.2 CCNCCOCC(=O)N 2230a_100015525214_100000076697 [0,1,1,0,0,0|1,0,1]=4 1132 B9R0.2 CCNCCOCC(F)F 2230a_100015525214_200012177212 [0,1,1,0,0,0|2,0,0]=4 1133 B9R0.2 CCOCCNCC(=O)N 2230a_100000711301_100011215890 [0,1,1,0,0,0|1,0,1]=4 1134 B9R0.2 CCOCCNCC(=O)N 2230a_102516460346_100000747473 [0,1,1,0,0,0|1,0,1]=4 1135 B9R0.2 CCOCCNCC(=O)N 34a_102516460346_100000187820 [0,1,1,0,0,0|1,0,1]=4 1136 B9R0.2 CCOCCNCC(C)C 2230a_100000210953_100011215890 [0,1,1,0,0,0|2,0,0]=4 1137 B9R0.2 CCOCCNCC(C)C 2230a_102516460346_100000210760 [0,1,1,0,0,0|2,0,0]=4 1138 B9R0.2 CCOCCNCC(C)C 270004a_102516460346_100000210432 [0,1,1,0,0,0|2,0,0]=4 1139 B9R0.2 CCOCCNCC(C)C 34a_100000210953_100000210147 [0,1,1,0,0,0|2,0,0]=4 1140 B9R0.2 CCOCCNCC(C)C 34a_100015185251_100000210202 [0,1,1,0,0,0|2,0,0]=4 1141 B9R0.2 CCOCCNCC(C)C 34a_102516460346_100000210624 [0,1,1,0,0,0|2,0,0]=4 1142 B9R0.2 CCOCCNCC(C)O 2230a_100000210904_100011215890 [0,1,1,0,0,0|2,0,0]=4 1143 B9R0.2 CCOCCNCC(C)O 2230a_102516460346_100011218427 [0,1,1,0,0,0|2,0,0]=4 1144 B9R0.2 CCOCCNCC(C)O 34a_100000210904_100000210147 [0,1,1,0,0,0|2,0,0]=4 1145 B9R0.2 CCOCCNCC(C)O 34a_102516460346_100011218427 [0,1,1,0,0,0|2,0,0]=4 1146 B9R0.2 CCOCCNCC(F)F 2230a_102516460346_100011934356 [0,1,1,0,0,0|2,0,0]=4 1147 B9R0.2 CCOCCNCC(F)F 34a_100000765723_100000210147 [0,1,1,0,0,0|2,0,0]=4 1148 B9R0.2 CCOCCNCC(F)F 34a_102516460346_100011934356 [0,1,1,0,0,0|2,0,0]=4 1149 B9R0.2 CCOCCNC[C@@H](C)O 2230a_102516460346_100009817552 [0,1,1,0,0,0|2,0,0]=4 1150 B9R0.2 CCOCCNC[C@@H](C)O 34a_102516460346_100009817552 [0,1,1,0,0,0|2,0,0]=4 1151 B9R0.2 CCOCCOC[C@@H](C)N 34a_100000737577_100000210147 [0,1,1,0,0,0|2,0,0]=4 1152 B9R0.2 CCSCCNCC(=O)N 2230a_100000106463_100000747473 [0,1,1,0,0,0|1,0,1]=4 1153 B9R0.2 CCSCCNCC(=O)N 2230a_100000711301_100000757381 [0,1,1,0,0,0|1,0,1]=4 1154 B9R0.2 CCSCCNCC(C)C 2230a_100000106463_100000210760 [0,1,1,0,0,0|2,0,0]=4 1155 B9R0.2 CCSCCNCC(C)C 2230a_100000210953_100000757381 [0,1,1,0,0,0|2,0,0]=4 1156 B9R0.2 CCSCCNCC(C)C 270004a_100000106463_100000210432 [0,1,1,0,0,0|2,0,0]=4 1157 B9R0.2 CCSCCNCC(C)C 34a_100000210953_100000757381 [0,1,1,0,0,0|2,0,0]=4 1158 B9R0.2 CCSCCNCC(C)O 2230a_100000106463_100011218427 [0,1,1,0,0,0|2,0,0]=4 1159 B9R0.2 CCSCCNCC(C)O 2230a_100000210904_100000757381 [0,1,1,0,0,0|2,0,0]=4 1160 B9R0.2 CCSCCNCC(C)O 34a_100000210904_100000757381 [0,1,1,0,0,0|2,0,0]=4 1161 B9R0.2 CCSCCNCC(F)F 2230a_100000106463_100011934356 [0,1,1,0,0,0|2,0,0]=4 1162 B9R0.2 CCSCCNCC(F)F 34a_100000765723_100000757381 [0,1,1,0,0,0|2,0,0]=4 1163 B9R0.2 CCSCCNC[C@@H](C)O 2230a_100000106463_100009817552 [0,1,1,0,0,0|2,0,0]=4 1164 B9R0.2 CCSCCOC[C@@H](C)N 34a_100000737577_100000757381 [0,1,1,0,0,0|2,0,0]=4 1165 B9R0.5 CCCC(C)CNCCF 34a_100000724931_100011216630 [0,1,1,0,0,0|2,0,0]=4 1166 B9R0.5 CCCC(C)CNCCO 2230a_100016997473_100011216630 [0,1,1,0,0,0|2,0,0]=4 1167 B9R0.5 CCCC(C)CNCCO 270004a_100000210304_100000243154 [0,1,1,0,0,0|2,0,0]=4 1168 B9R0.5 CCCC(C)CNCCO 34a_100016990907_100011216630 [0,1,1,0,0,0|2,0,0]=4 1169 B9R0.5 CCCC(C)COCCN 34a_100000210304_100011216630 [0,1,1,0,0,0|2,0,0]=4 1170 B9R0.5 CCCCCC(C)NCC 2230a_100000211957_100000210202 [0,1,1,0,0,0|2,0,0]=4 1171 B9R0.5 CCCCCC(C)NCC 2230a_100015525214_200011218191 [0,1,1,0,0,0|2,0,0]=4 1172 B9R0.5 CCCCCC(C)NCC 270004a_100015525214_100000211708 [0,1,1,0,0,0|2,0,0]=4 1173 B9R0.5 CCCCCN(C)CCC 2230a_100000223495_100000210303 [0,1,1,0,0,0|2,0,0]=4 1174 B9R0.5 CCCCCN(C)CCC 2230a_100000747261_100000210326 [0,1,1,0,0,0|2,0,0]=4 1175 B9R0.5 CCCCCN(C)CCC 2230a_200000226819_200000210301 [0,1,1,0,0,0|2,0,0]=4 1176 B9R0.5 CCCCCN(C)CCC 269982a_100000223495_100000210303 [0,1,1,0,0,0|2,0,0]=4 1177 B9R0.5 CCCCCN(C)CCC 269982a_100000747261_100000210215 [0,1,1,0,0,0|2,0,0]=4 1178 B9R0.5 CCCCCN(C)CCC 269982a_200000226819_200000210301 [0,1,1,0,0,0|2,0,0]=4 1179 B9R0.5 CCCCCN(C)CCF 2230a_100000223495_100011217306 [0,1,1,0,0,0|2,0,0]=4 1180 B9R0.5 CCCCCN(C)CCF 269982a_100000223495_100011217306 [0,1,1,0,0,0|2,0,0]=4 1181 B9R0.5 CCCCCN(C)CCO 2230a_100000210263_100000210326 [0,1,1,0,0,0|2,0,0]=4 1182 B9R0.5 CCCCCN(C)CCO 2230a_100000223495_100000211926 [0,1,1,0,0,0|2,0,0]=4 1183 B9R0.5 CCCCCN(C)CCO 2230a_100000224656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1184 B9R0.5 CCCCCN(C)CCO 269982a_100000210263_100000210215 [0,1,1,0,0,0|2,0,0]=4 1185 B9R0.5 CCCCCN(C)CCO 269982a_100000223495_100000211926 [0,1,1,0,0,0|2,0,0]=4 1186 B9R0.5 CCCCCN(C)CCO 269982a_100000224656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1187 B9R0.5 CCCCCN([13CH3])CCC 2230a_200000226819_200025704644 [0,1,1,0,0,0|2,0,0]=4 1188 B9R0.5 CCCCCN([13CH3])CCC 269982a_200000226819_200025704644 [0,1,1,0,0,0|2,0,0]=4 1189 B9R0.5 CCCCCN([13CH3])CCO 2230a_100000224656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1190 B9R0.5 CCCCCN([13CH3])CCO 269982a_100000224656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1191 B9R0.5 CCCN(C)CCOCC 2230a_100000747261_100011215890 [0,1,1,0,0,0|2,0,0]=4 1192 B9R0.5 CCCN(C)CCOCC 269982a_100000747261_100011215890 [0,1,1,0,0,0|2,0,0]=4 1193 B9R0.5 CCCN(C)CCSCC 2230a_100000747261_100000757381 [0,1,1,0,0,0|2,0,0]=4 1194 B9R0.5 CCCN(C)CCSCC 269982a_100000747261_100000757381 [0,1,1,0,0,0|2,0,0]=4 1195 B9R0.5 CCCNCC(=O)NCC 2230a_100016988866_100000210303 [0,1,1,0,0,0|1,0,1]=4 1196 B9R0.5 CCCNCC(C)CCC 270004a_100020643023_100000243154 [0,1,1,0,0,0|2,0,0]=4 1197 B9R0.5 CCCSCC(C)NCC 270004a_100015525214_100011343953 [0,1,1,0,0,0|2,0,0]=4 1198 B9R0.5 CCNC(=O)CNCCF 2230a_100016988866_100011217306 [0,1,1,0,0,0|1,0,1]=4 1199 B9R0.5 CCNC(=O)CNCCF 34a_100000724931_100000183381 [0,1,1,0,0,0|1,0,1]=4 1200 B9R0.5 CCNC(=O)CNCCO 2230a_100016988866_100000211926 [0,1,1,0,0,0|1,0,1]=4 1201 B9R0.5 CCNC(=O)CNCCO 2230a_100016997473_100000183381 [0,1,1,0,0,0|1,0,1]=4 1202 B9R0.5 CCNC(=O)CNCCO 34a_100016990907_100000183381 [0,1,1,0,0,0|1,0,1]=4 1203 B9R0.5 CCNC(=O)COCCN 34a_100000210304_100000183381 [0,1,1,0,0,0|1,0,1]=4 1204 B9R0.5 CCOCCN(C)CCO 2230a_100000210263_100011215890 [0,1,1,0,0,0|2,0,0]=4 1205 B9R0.5 CCOCCN(C)CCO 269982a_100000210263_100011215890 [0,1,1,0,0,0|2,0,0]=4 1206 B9R0.5 CCSCCN(C)CCO 2230a_100000210263_100000757381 [0,1,1,0,0,0|2,0,0]=4 1207 B9R0.5 CCSCCN(C)CCO 269982a_100000210263_100000757381 [0,1,1,0,0,0|2,0,0]=4 1208 B9R0.18 CCCCC(C)NCCC 2230a_100000126638_100000210303 [0,1,1,0,0,0|2,0,0]=4 1209 B9R0.18 CCCCC(C)NCCC 270004a_100020643023_100000210087 [0,1,1,0,0,0|2,0,0]=4 1210 B9R0.18 CCCCC(C)NCCF 2230a_100000126638_100011217306 [0,1,1,0,0,0|2,0,0]=4 1211 B9R0.18 CCCCC(C)NCCF 34a_100000724931_200011215066 [0,1,1,0,0,0|2,0,0]=4 1212 B9R0.18 CCCCC(C)NCCO 2230a_100000126638_100000211926 [0,1,1,0,0,0|2,0,0]=4 1213 B9R0.18 CCCCC(C)NCCO 2230a_100016997473_200011215066 [0,1,1,0,0,0|2,0,0]=4 1214 B9R0.18 CCCCC(C)NCCO 270004a_100000210304_100000210087 [0,1,1,0,0,0|2,0,0]=4 1215 B9R0.18 CCCCC(C)NCCO 34a_100016990907_200011215066 [0,1,1,0,0,0|2,0,0]=4 1216 B9R0.18 CCCCC(C)OCCN 34a_100000210304_200011215066 [0,1,1,0,0,0|2,0,0]=4 1217 B9R0.18 CCCNC(=O)CNCC 2230a_100000174927_100000210202 [0,1,1,0,0,0|1,0,1]=4 1218 B9R0.18 CCCNC(=O)CNCC 2230a_100015525214_100000183358 [0,1,1,0,0,0|1,0,1]=4 1219 B9R0.18 CCCNC(C)CSCC 270004a_100020643023_200011216171 [0,1,1,0,0,0|2,0,0]=4 1220 B9R0.18 CCCOC(C)CNCC 2230a_100015185124_100000210202 [0,1,1,0,0,0|2,0,0]=4 1221 B9R0.18 CCCOC(C)CNCC 34a_100015185124_100000210202 [0,1,1,0,0,0|2,0,0]=4 1222 B9R0.18 CCNCC(=O)NCCF 2230a_100000725713_100000210202 [0,1,1,0,0,0|1,0,1]=4 1223 B9R0.18 CCNC[C@H](C)CCCO 2230a_100160569302_100000210202 [0,1,1,0,0,0|2,0,0]=4 1224 B9R0.18 CCNC[C@H](C)CCCO 34a_100160569302_100000210202 [0,1,1,0,0,0|2,0,0]=4 1225 B9R0.18 CCSCC(C)NCCO 270004a_100000210304_200011216171 [0,1,1,0,0,0|2,0,0]=4 1226 B9R0.45 C#CCCCCCNCC 2230a_100015525214_100012094781 [0,1,1,0,0,0|2,0,0]=4 1227 B9R0.45 C#CCCNCCCCC 2230a_100000209983_100000688953 [0,1,1,0,0,0|2,0,0]=4 1228 B9R0.45 C#CCCNCCCCC 34a_100000755551_100000718602 [0,1,1,0,0,0|2,0,0]=4 1229 B9R0.45 C#CCCNCCOCC 2230a_102516460346_100000688953 [0,1,1,0,0,0|2,0,0]=4 1230 B9R0.45 C#CCCNCCOCC 34a_100000755551_100000210147 [0,1,1,0,0,0|2,0,0]=4 1231 B9R0.45 C#CCCNCCOCC 34a_102516460346_100000688953 [0,1,1,0,0,0|2,0,0]=4 1232 B9R0.45 C#CCCNCCSCC 2230a_100000106463_100000688953 [0,1,1,0,0,0|2,0,0]=4 1233 B9R0.45 C#CCCNCCSCC 34a_100000755551_100000757381 [0,1,1,0,0,0|2,0,0]=4 1234 B9R0.45 C=CCCCCCNCC 2230a_100015525214_100000700193 [0,1,1,0,0,0|2,0,0]=4 1235 B9R0.45 C=CCCNCCCCC 2230a_100000209983_100000754431 [0,1,1,0,0,0|2,0,0]=4 1236 B9R0.45 C=CCCNCCCCC 2230a_100015191253_100000210326 [0,1,1,0,0,0|2,0,0]=4 1237 B9R0.45 C=CCCNCCOCC 2230a_100015191253_100011215890 [0,1,1,0,0,0|2,0,0]=4 1238 B9R0.45 C=CCCNCCOCC 2230a_102516460346_100000754431 [0,1,1,0,0,0|2,0,0]=4 1239 B9R0.45 C=CCCNCCOCC 34a_102516460346_100000754431 [0,1,1,0,0,0|2,0,0]=4 1240 B9R0.45 C=CCCNCCSCC 2230a_100000106463_100000754431 [0,1,1,0,0,0|2,0,0]=4 1241 B9R0.45 C=CCCNCCSCC 2230a_100015191253_100000757381 [0,1,1,0,0,0|2,0,0]=4 1242 B9R0.45 CC/C=C\CCNCCF 34a_100000724931_100015370543 [0,1,1,0,0,0|2,0,0]=4 1243 B9R0.45 CC/C=C\CCNCCO 2230a_100016997473_100015370543 [0,1,1,0,0,0|2,0,0]=4 1244 B9R0.45 CC/C=C\CCNCCO 34a_100016990907_100015370543 [0,1,1,0,0,0|2,0,0]=4 1245 B9R0.45 CC/C=C\CCOCCN 34a_100000210304_100015370543 [0,1,1,0,0,0|2,0,0]=4 1246 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [0,1,1,0,0,0|2,0,0]=4 1247 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [0,1,1,0,0,0|2,0,0]=4 1248 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [0,1,1,0,0,0|2,0,0]=4 1249 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [0,1,1,0,0,0|2,0,0]=4 1250 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [0,1,1,0,0,0|2,0,0]=4 1251 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [0,1,1,0,0,0|2,0,0]=4 1252 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [0,1,1,0,0,0|2,0,0]=4 1253 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [0,1,1,0,0,0|2,0,0]=4 1254 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [0,1,1,0,0,0|2,0,0]=4 1255 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [0,1,1,0,0,0|2,0,0]=4 1256 B9R0.45 CCCCCCNCCF 2230a_100000210581_100011217306 [0,1,1,0,0,0|2,0,0]=4 1257 B9R0.45 CCCCCCNCCF 34a_100000724931_100000210314 [0,1,1,0,0,0|2,0,0]=4 1258 B9R0.45 CCCCCCNCCO 2230a_100000210581_100000211926 [0,1,1,0,0,0|2,0,0]=4 1259 B9R0.45 CCCCCCNCCO 2230a_100016997473_100000210314 [0,1,1,0,0,0|2,0,0]=4 1260 B9R0.45 CCCCCCNCCO 34a_100016990907_100000210314 [0,1,1,0,0,0|2,0,0]=4 1261 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [0,1,1,0,0,0|2,0,0]=4 1262 B9R0.45 CCCCCCNCSC 2230a_100000210581_100011218213 [0,1,1,0,0,0|2,0,0]=4 1263 B9R0.45 CCCCCCOCCN 34a_100000210304_100000210314 [0,1,1,0,0,0|2,0,0]=4 1264 B9R0.45 CCCCCNCCC#N 2230a_100000209983_100011215226 [0,1,1,0,0,0|1,0,1]=4 1265 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [0,1,1,0,0,0|2,0,0]=4 1266 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [0,1,1,0,0,0|2,0,0]=4 1267 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [0,1,1,0,0,0|2,0,0]=4 1268 B9R0.45 CCCCCNCCCF 2230a_100000209983_100011934791 [0,1,1,0,0,0|2,0,0]=4 1269 B9R0.45 CCCCCNCCCF 2230a_100015189416_100000210326 [0,1,1,0,0,0|2,0,0]=4 1270 B9R0.45 CCCCCNCCCF 34a_100015189416_100000718602 [0,1,1,0,0,0|2,0,0]=4 1271 B9R0.45 CCCCCNCCCO 2230a_100000209983_100000230001 [0,1,1,0,0,0|2,0,0]=4 1272 B9R0.45 CCCCCNCCOC 2230a_100000209980_100000210326 [0,1,1,0,0,0|2,0,0]=4 1273 B9R0.45 CCCCCNCCOC 2230a_100000209983_100011201679 [0,1,1,0,0,0|2,0,0]=4 1274 B9R0.45 CCCCCNCCOC 34a_100000224656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1275 B9R0.45 CCCCCNCCO[13CH3] 34a_100000224656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1276 B9R0.45 CCCCCNCCSC 2230a_100000209983_100000751147 [0,1,1,0,0,0|2,0,0]=4 1277 B9R0.45 CCCCCNCCSC 2230a_100020590264_100000210326 [0,1,1,0,0,0|2,0,0]=4 1278 B9R0.45 CCCCCOCCCN 34a_100000182051_100000718602 [0,1,1,0,0,0|2,0,0]=4 1279 B9R0.45 CCCCCOCCON 34a_100000700252_100000718602 [0,1,1,0,0,0|2,0,0]=4 1280 B9R0.45 CCCCNCCOCC 2230a_100000102301_100011215890 [0,1,1,0,0,0|2,0,0]=4 1281 B9R0.45 CCCCNCCOCC 2230a_102516460346_100000210211 [0,1,1,0,0,0|2,0,0]=4 1282 B9R0.45 CCCCNCCOCC 34a_102516460346_100000210210 [0,1,1,0,0,0|2,0,0]=4 1283 B9R0.45 CCCCNCCOCC 7a_106832991798_100011215890 [0,1,1,0,0,0|2,0,0]=4 1284 B9R0.45 CCCCNCCSCC 2230a_100000102301_100000757381 [0,1,1,0,0,0|2,0,0]=4 1285 B9R0.45 CCCCNCCSCC 2230a_100000106463_100000210211 [0,1,1,0,0,0|2,0,0]=4 1286 B9R0.45 CCCCNCCSCC 7a_106832991798_100000757381 [0,1,1,0,0,0|2,0,0]=4 1287 B9R0.45 CCCCOCCCCN 34a_100000750430_100000210210 [0,1,1,0,0,0|2,0,0]=4 1288 B9R0.45 CCCCOCCNCC 2230a_100015525214_100000743108 [0,1,1,0,0,0|2,0,0]=4 1289 B9R0.45 CCCCOCNCCF 34a_100000724931_100011995733 [0,1,1,0,0,0|2,0,0]=4 1290 B9R0.45 CCCCOCNCCO 2230a_100016997473_100011995733 [0,1,1,0,0,0|2,0,0]=4 1291 B9R0.45 CCCCOCNCCO 34a_100016990907_100011995733 [0,1,1,0,0,0|2,0,0]=4 1292 B9R0.45 CCCCOCOCCN 34a_100000210304_100011995733 [0,1,1,0,0,0|2,0,0]=4 1293 B9R0.45 CCCCSCCNCC 2230a_100025743550_100000210202 [0,1,1,0,0,0|2,0,0]=4 1294 B9R0.45 CCCNCCCCCO 2230a_100000762737_100000210303 [0,1,1,0,0,0|2,0,0]=4 1295 B9R0.45 CCCNCCCCCO 34a_100000762737_100000210303 [0,1,1,0,0,0|2,0,0]=4 1296 B9R0.45 CCCNCCCOCC 2230a_100000210961_100000210303 [0,1,1,0,0,0|2,0,0]=4 1297 B9R0.45 CCCNCCCOCC 34a_100000210961_100000210303 [0,1,1,0,0,0|2,0,0]=4 1298 B9R0.45 CCCNCCOCCC 2230a_100161115042_100000210303 [0,1,1,0,0,0|2,0,0]=4 1299 B9R0.45 CCCNCCOCCC 34a_100161115042_100000210303 [0,1,1,0,0,0|2,0,0]=4 1300 B9R0.45 CCCNCCOCCO 2230a_100000211614_100000210303 [0,1,1,0,0,0|2,0,0]=4 1301 B9R0.45 CCCNCCOCCO 34a_100000211614_100000210303 [0,1,1,0,0,0|2,0,0]=4 1302 B9R0.45 CCCNCCSCCC 2230a_100020603323_100000210303 [0,1,1,0,0,0|2,0,0]=4 1303 B9R0.45 CCCNCCSCCO 2230a_100011219999_100000210303 [0,1,1,0,0,0|2,0,0]=4 1304 B9R0.45 CCCOCCCCCN 34a_100000762737_100000210303 [0,1,1,0,0,0|2,0,0]=4 1305 B9R0.45 CCCOCCCNCC 2230a_100011217757_100000210202 [0,1,1,0,0,0|2,0,0]=4 1306 B9R0.45 CCCOCCCNCC 34a_100011217757_100000210202 [0,1,1,0,0,0|2,0,0]=4 1307 B9R0.45 CCCOCCNCCF 2230a_100161115042_100011217306 [0,1,1,0,0,0|2,0,0]=4 1308 B9R0.45 CCCOCCNCCF 34a_100000724931_100011215938 [0,1,1,0,0,0|2,0,0]=4 1309 B9R0.45 CCCOCCNCCF 34a_100161115042_100011217306 [0,1,1,0,0,0|2,0,0]=4 1310 B9R0.45 CCCOCCNCCO 2230a_100016997473_100011215938 [0,1,1,0,0,0|2,0,0]=4 1311 B9R0.45 CCCOCCNCCO 2230a_100161115042_100000211926 [0,1,1,0,0,0|2,0,0]=4 1312 B9R0.45 CCCOCCNCCO 34a_100016990907_100011215938 [0,1,1,0,0,0|2,0,0]=4 1313 B9R0.45 CCCOCCNCCO 34a_100161115042_100000211926 [0,1,1,0,0,0|2,0,0]=4 1314 B9R0.45 CCCOCCNCOC 2230a_100161115042_100000766300 [0,1,1,0,0,0|2,0,0]=4 1315 B9R0.45 CCCOCCNCSC 2230a_100161115042_100011218213 [0,1,1,0,0,0|2,0,0]=4 1316 B9R0.45 CCCOCCNCSC 34a_100161115042_100011218213 [0,1,1,0,0,0|2,0,0]=4 1317 B9R0.45 CCCOCCOCCN 34a_100000210304_100011215938 [0,1,1,0,0,0|2,0,0]=4 1318 B9R0.45 CCCOCCOCCN 34a_100000211614_100000210303 [0,1,1,0,0,0|2,0,0]=4 1319 B9R0.45 CCCSCCNCCF 2230a_100020603323_100011217306 [0,1,1,0,0,0|2,0,0]=4 1320 B9R0.45 CCCSCCNCCO 2230a_100020603323_100000211926 [0,1,1,0,0,0|2,0,0]=4 1321 B9R0.45 CCCSCCNCOC 2230a_100020603323_100000766300 [0,1,1,0,0,0|2,0,0]=4 1322 B9R0.45 CCCSCCNCSC 2230a_100020603323_100011218213 [0,1,1,0,0,0|2,0,0]=4 1323 B9R0.45 CCNCCCCCC#N 2230a_100015525214_100009813376 [0,1,1,0,0,0|1,0,1]=4 1324 B9R0.45 CCNCCCCCC=O 2230a_100015525214_100000139337 [0,1,1,0,0,0|2,0,0]=4 1325 B9R0.45 CCNCCCCCCF 2230a_100015525214_100015922095 [0,1,1,0,0,0|2,0,0]=4 1326 B9R0.45 CCNCCCCCCO 2230a_100000686447_100000210202 [0,1,1,0,0,0|2,0,0]=4 1327 B9R0.45 CCNCCCCCCO 2230a_100015525214_100000766143 [0,1,1,0,0,0|2,0,0]=4 1328 B9R0.45 CCNCCCCCCO 34a_100000686447_100000210202 [0,1,1,0,0,0|2,0,0]=4 1329 B9R0.45 CCNCCCCCOC 2230a_100000747528_100000210202 [0,1,1,0,0,0|2,0,0]=4 1330 B9R0.45 CCNCCCCCOC 34a_100000747528_100000210202 [0,1,1,0,0,0|2,0,0]=4 1331 B9R0.45 CCNCCOCCOC 2230a_100000745349_100000210202 [0,1,1,0,0,0|2,0,0]=4 1332 B9R0.45 CCNCCOCCOC 2230a_100015525214_100000695917 [0,1,1,0,0,0|2,0,0]=4 1333 B9R0.45 CCNCCOCCOC 34a_100000745349_100000210202 [0,1,1,0,0,0|2,0,0]=4 1334 B9R0.45 CCOCCCCCCN 34a_100000686447_100000210202 [0,1,1,0,0,0|2,0,0]=4 1335 B9R0.45 CCOCCCCCNC 34a_100000722520_100000210202 [0,1,1,0,0,0|2,0,0]=4 1336 B9R0.45 CCOCCCNCCF 2230a_100000210961_100011217306 [0,1,1,0,0,0|2,0,0]=4 1337 B9R0.45 CCOCCCNCCF 34a_100000210961_100011217306 [0,1,1,0,0,0|2,0,0]=4 1338 B9R0.45 CCOCCCNCCF 34a_100000724931_100012232248 [0,1,1,0,0,0|2,0,0]=4 1339 B9R0.45 CCOCCCNCCO 2230a_100000210961_100000211926 [0,1,1,0,0,0|2,0,0]=4 1340 B9R0.45 CCOCCCNCCO 2230a_100016997473_100012232248 [0,1,1,0,0,0|2,0,0]=4 1341 B9R0.45 CCOCCCNCCO 34a_100000210961_100000211926 [0,1,1,0,0,0|2,0,0]=4 1342 B9R0.45 CCOCCCNCCO 34a_100016990907_100012232248 [0,1,1,0,0,0|2,0,0]=4 1343 B9R0.45 CCOCCCOCCN 34a_100000210304_100012232248 [0,1,1,0,0,0|2,0,0]=4 1344 B9R0.45 CCOCCNCCC#N 2230a_102516460346_100011215226 [0,1,1,0,0,0|1,0,1]=4 1345 B9R0.45 CCOCCNCCCF 2230a_100015189416_100011215890 [0,1,1,0,0,0|2,0,0]=4 1346 B9R0.45 CCOCCNCCCF 2230a_102516460346_100011934791 [0,1,1,0,0,0|2,0,0]=4 1347 B9R0.45 CCOCCNCCCF 34a_100015189416_100000210147 [0,1,1,0,0,0|2,0,0]=4 1348 B9R0.45 CCOCCNCCCF 34a_102516460346_100011934791 [0,1,1,0,0,0|2,0,0]=4 1349 B9R0.45 CCOCCNCCCO 2230a_102516460346_100000230001 [0,1,1,0,0,0|2,0,0]=4 1350 B9R0.45 CCOCCNCCCO 34a_102516460346_100000230001 [0,1,1,0,0,0|2,0,0]=4 1351 B9R0.45 CCOCCNCCOC 2230a_100000209980_100011215890 [0,1,1,0,0,0|2,0,0]=4 1352 B9R0.45 CCOCCNCCOC 2230a_102516460346_100011201679 [0,1,1,0,0,0|2,0,0]=4 1353 B9R0.45 CCOCCNCCOC 34a_102516460346_100011201679 [0,1,1,0,0,0|2,0,0]=4 1354 B9R0.45 CCOCCNCCSC 2230a_100020590264_100011215890 [0,1,1,0,0,0|2,0,0]=4 1355 B9R0.45 CCOCCNCCSC 2230a_102516460346_100000751147 [0,1,1,0,0,0|2,0,0]=4 1356 B9R0.45 CCOCCNCCSC 34a_102516460346_100000212216 [0,1,1,0,0,0|2,0,0]=4 1357 B9R0.45 CCOCCOCCCN 34a_100000182051_100000210147 [0,1,1,0,0,0|2,0,0]=4 1358 B9R0.45 CCOCCOCCNC 2230a_100102712874_200000210301 [0,1,1,0,0,0|2,0,0]=4 1359 B9R0.45 CCOCCOCCNC 2230a_106832991635_100011211534 [0,1,1,0,0,0|2,0,0]=4 1360 B9R0.45 CCOCCOCCNC 34a_100000228057_100000210202 [0,1,1,0,0,0|2,0,0]=4 1361 B9R0.45 CCOCCOCCNC 34a_100102657272_100011211534 [0,1,1,0,0,0|2,0,0]=4 1362 B9R0.45 CCOCCOCCNC 34a_100102712874_200000210301 [0,1,1,0,0,0|2,0,0]=4 1363 B9R0.45 CCOCCOCCNC 7a_106832991635_100011211534 [0,1,1,0,0,0|2,0,0]=4 1364 B9R0.45 CCOCCOCCN[13CH3] 2230a_100102712874_200025704644 [0,1,1,0,0,0|2,0,0]=4 1365 B9R0.45 CCOCCOCCN[13CH3] 34a_100102712874_200025704644 [0,1,1,0,0,0|2,0,0]=4 1366 B9R0.45 CCOCCOCCON 34a_100000700252_100000210147 [0,1,1,0,0,0|2,0,0]=4 1367 B9R0.45 CCSCCNCCC#N 2230a_100000106463_100011215226 [0,1,1,0,0,0|1,0,1]=4 1368 B9R0.45 CCSCCNCCCF 2230a_100000106463_100011934791 [0,1,1,0,0,0|2,0,0]=4 1369 B9R0.45 CCSCCNCCCF 2230a_100015189416_100000757381 [0,1,1,0,0,0|2,0,0]=4 1370 B9R0.45 CCSCCNCCCF 34a_100015189416_100000757381 [0,1,1,0,0,0|2,0,0]=4 1371 B9R0.45 CCSCCNCCCO 2230a_100000106463_100000230001 [0,1,1,0,0,0|2,0,0]=4 1372 B9R0.45 CCSCCNCCOC 2230a_100000106463_100011201679 [0,1,1,0,0,0|2,0,0]=4 1373 B9R0.45 CCSCCNCCOC 2230a_100000209980_100000757381 [0,1,1,0,0,0|2,0,0]=4 1374 B9R0.45 CCSCCNCCSC 2230a_100000106463_100000751147 [0,1,1,0,0,0|2,0,0]=4 1375 B9R0.45 CCSCCNCCSC 2230a_100020590264_100000757381 [0,1,1,0,0,0|2,0,0]=4 1376 B9R0.45 CCSCCOCCCN 34a_100000182051_100000757381 [0,1,1,0,0,0|2,0,0]=4 1377 B9R0.45 CCSCCOCCON 34a_100000700252_100000757381 [0,1,1,0,0,0|2,0,0]=4 1378 B9R0.45 COCCCCCCCN 34a_100011996573_200000210301 [0,1,1,0,0,0|2,0,0]=4 1379 B9R0.45 COCCCCNCCF 34a_100000724931_100000755781 [0,1,1,0,0,0|2,0,0]=4 1380 B9R0.45 COCCCCNCCO 2230a_100016997473_100000730899 [0,1,1,0,0,0|2,0,0]=4 1381 B9R0.45 COCCCCNCCO 34a_100016990907_100000755781 [0,1,1,0,0,0|2,0,0]=4 1382 B9R0.45 COCCCCOCCN 34a_100000210304_100000755781 [0,1,1,0,0,0|2,0,0]=4 1383 B9R0.45 COCNCCCCCO 2230a_100000762737_100000766300 [0,1,1,0,0,0|2,0,0]=4 1384 B9R0.45 COCNCCOCCO 2230a_100000211614_100000766300 [0,1,1,0,0,0|2,0,0]=4 1385 B9R0.45 COCNCCSCCO 2230a_100011219999_100000766300 [0,1,1,0,0,0|2,0,0]=4 1386 B9R0.45 CSCNCCCCCO 2230a_100000762737_100011218213 [0,1,1,0,0,0|2,0,0]=4 1387 B9R0.45 CSCNCCCCCO 34a_100000762737_100011218213 [0,1,1,0,0,0|2,0,0]=4 1388 B9R0.45 CSCNCCOCCO 2230a_100000211614_100011218213 [0,1,1,0,0,0|2,0,0]=4 1389 B9R0.45 CSCNCCOCCO 34a_100000211614_100011218213 [0,1,1,0,0,0|2,0,0]=4 1390 B9R0.45 CSCNCCSCCO 2230a_100011219999_100011218213 [0,1,1,0,0,0|2,0,0]=4 1391 B9R0.45 CSCOCCCCCN 34a_100000762737_100011218213 [0,1,1,0,0,0|2,0,0]=4 1392 B9R0.45 CSCOCCOCCN 34a_100000211614_100011218213 [0,1,1,0,0,0|2,0,0]=4 1393 B9R0.45 FCCCCCNCCF 34a_100000724931_100000729378 [0,1,1,0,0,0|2,0,0]=4 1394 B9R0.45 NCCCCCOCCF 34a_100000762737_100011217306 [0,1,1,0,0,0|2,0,0]=4 1395 B9R0.45 NCCCCCOCCO 34a_100000762737_100000211926 [0,1,1,0,0,0|2,0,0]=4 1396 B9R0.45 NCCOCCCCCF 34a_100000210304_100000729378 [0,1,1,0,0,0|2,0,0]=4 1397 B9R0.45 NCCOCCCCCO 34a_100000210304_100000746330 [0,1,1,0,0,0|2,0,0]=4 1398 B9R0.45 NCCOCCOCCF 34a_100000211614_100011217306 [0,1,1,0,0,0|2,0,0]=4 1399 B9R0.45 NCCOCCOCCO 34a_100000210304_100000692535 [0,1,1,0,0,0|2,0,0]=4 1400 B9R0.45 NCCOCCOCCO 34a_100000211614_100000211926 [0,1,1,0,0,0|2,0,0]=4 1401 B9R0.45 OCCCCCNCCF 2230a_100000762737_100011217306 [0,1,1,0,0,0|2,0,0]=4 1402 B9R0.45 OCCCCCNCCF 34a_100000724931_100000746330 [0,1,1,0,0,0|2,0,0]=4 1403 B9R0.45 OCCCCCNCCF 34a_100000762737_100011217306 [0,1,1,0,0,0|2,0,0]=4 1404 B9R0.45 OCCCCCNCCO 2230a_100000762737_100000211926 [0,1,1,0,0,0|2,0,0]=4 1405 B9R0.45 OCCCCCNCCO 2230a_100016997473_100000746330 [0,1,1,0,0,0|2,0,0]=4 1406 B9R0.45 OCCCCCNCCO 34a_100000762737_100000211926 [0,1,1,0,0,0|2,0,0]=4 1407 B9R0.45 OCCCCCNCCO 34a_100016990907_100000746330 [0,1,1,0,0,0|2,0,0]=4 1408 B9R0.45 OCCNCCCCCF 2230a_100016997473_100000729378 [0,1,1,0,0,0|2,0,0]=4 1409 B9R0.45 OCCNCCCCCF 34a_100016990907_100000729378 [0,1,1,0,0,0|2,0,0]=4 1410 B9R0.45 OCCNCCOCCO 2230a_100000211614_100000211926 [0,1,1,0,0,0|2,0,0]=4 1411 B9R0.45 OCCNCCOCCO 2230a_100016997473_100011215305 [0,1,1,0,0,0|2,0,0]=4 1412 B9R0.45 OCCNCCOCCO 34a_100000211614_100000211926 [0,1,1,0,0,0|2,0,0]=4 1413 B9R0.45 OCCNCCOCCO 34a_100016990907_100000692535 [0,1,1,0,0,0|2,0,0]=4 1414 B9R0.45 OCCNCCSCCO 2230a_100011219999_100000211926 [0,1,1,0,0,0|2,0,0]=4 1415 B9R0.45 OCCOCCNCCF 2230a_100000211614_100011217306 [0,1,1,0,0,0|2,0,0]=4 1416 B9R0.45 OCCOCCNCCF 34a_100000211614_100011217306 [0,1,1,0,0,0|2,0,0]=4 1417 B9R0.45 OCCOCCNCCF 34a_100000724931_100000692535 [0,1,1,0,0,0|2,0,0]=4 1418 B9R0.45 OCCSCCNCCF 2230a_100011219999_100011217306 [0,1,1,0,0,0|2,0,0]=4 1419 B9R0.45 [13CH3]OCCCCCCCN 34a_100011996573_200025704644 [0,1,1,0,0,0|2,0,0]=4 1420 B9R0.46 CCC(C)CCNCCF 2230a_100020591266_100011217306 [0,1,1,0,0,0|2,0,0]=4 1421 B9R0.46 CCC(C)CCNCCO 2230a_100020591266_100000211926 [0,1,1,0,0,0|2,0,0]=4 1422 B9R0.46 CCCCCCN(C)CC 2230a_100000225621_100000210314 [0,1,1,0,0,0|2,0,0]=4 1423 B9R0.46 CCCCCCN(C)CC 2230a_106256046315_100000210202 [0,1,1,0,0,0|2,0,0]=4 1424 B9R0.46 CCCCCCN(C)CC 269982a_100000225621_100000210757 [0,1,1,0,0,0|2,0,0]=4 1425 B9R0.46 CCCCCCN(C)CC 269982a_106256046315_100000204670 [0,1,1,0,0,0|2,0,0]=4 1426 B9R0.46 CCCCCNC(C)CC 2230a_100000209981_100000210326 [0,1,1,0,0,0|2,0,0]=4 1427 B9R0.46 CCCCCNC(C)CC 2230a_100000209983_100000758301 [0,1,1,0,0,0|2,0,0]=4 1428 B9R0.46 CCCCCNC(C)CO 2230a_100000209983_100012180447 [0,1,1,0,0,0|2,0,0]=4 1429 B9R0.46 CCCCCN[C@H](C)CO 2230a_100000737577_100000210326 [0,1,1,0,0,0|2,0,0]=4 1430 B9R0.46 CCCCCOC(C)CN 34a_100000210904_100000718602 [0,1,1,0,0,0|2,0,0]=4 1431 B9R0.46 CCCNCCC(C)CC 2230a_100020591266_100000210303 [0,1,1,0,0,0|2,0,0]=4 1432 B9R0.46 CCCOCCN(C)CC 2230a_100000225621_100011215938 [0,1,1,0,0,0|2,0,0]=4 1433 B9R0.46 CCCOCCN(C)CC 269982a_100000225621_100011215938 [0,1,1,0,0,0|2,0,0]=4 1434 B9R0.46 CCN(C)CCCCCF 2230a_100000225621_100000729378 [0,1,1,0,0,0|2,0,0]=4 1435 B9R0.46 CCN(C)CCCCCF 269982a_100000225621_100000729378 [0,1,1,0,0,0|2,0,0]=4 1436 B9R0.46 CCN(C)CCCCCO 2230a_100000225621_100000746330 [0,1,1,0,0,0|2,0,0]=4 1437 B9R0.46 CCN(C)CCCCCO 2230a_100000722520_100000210202 [0,1,1,0,0,0|2,0,0]=4 1438 B9R0.46 CCN(C)CCCCCO 269982a_100000225621_100000746330 [0,1,1,0,0,0|2,0,0]=4 1439 B9R0.46 CCN(C)CCCCCO 269982a_100000722520_100000204670 [0,1,1,0,0,0|2,0,0]=4 1440 B9R0.46 CCN(C)CCOCCO 2230a_100000225621_100011215305 [0,1,1,0,0,0|2,0,0]=4 1441 B9R0.46 CCN(C)CCOCCO 2230a_100000228057_100000210202 [0,1,1,0,0,0|2,0,0]=4 1442 B9R0.46 CCN(C)CCOCCO 269982a_100000225621_100011215305 [0,1,1,0,0,0|2,0,0]=4 1443 B9R0.46 CCN(C)CCOCCO 269982a_100000228057_100000204670 [0,1,1,0,0,0|2,0,0]=4 1444 B9R0.46 CCNCCNC(=O)CC 34a_100132302217_100000210202 [0,1,1,0,0,0|1,0,1]=4 1445 B9R0.46 CCOCCC[C@@H](C)CN 34a_100160569302_100000210202 [0,1,1,0,0,0|2,0,0]=4 1446 B9R0.46 CCOCCNC(C)CC 2230a_100000209981_100011215890 [0,1,1,0,0,0|2,0,0]=4 1447 B9R0.46 CCOCCNC(C)CC 2230a_102516460346_100000758301 [0,1,1,0,0,0|2,0,0]=4 1448 B9R0.46 CCOCCNC(C)CC 34a_102516460346_100011215416 [0,1,1,0,0,0|2,0,0]=4 1449 B9R0.46 CCOCCNC(C)CO 2230a_102516460346_100012180447 [0,1,1,0,0,0|2,0,0]=4 1450 B9R0.46 CCOCCNC(C)CO 34a_102516460346_100012180447 [0,1,1,0,0,0|2,0,0]=4 1451 B9R0.46 CCOCCN[C@H](C)CO 2230a_100000737577_100011215890 [0,1,1,0,0,0|2,0,0]=4 1452 B9R0.46 CCOCCOC(C)CN 34a_100000210904_100000210147 [0,1,1,0,0,0|2,0,0]=4 1453 B9R0.46 CCSCCNC(C)CC 2230a_100000106463_100000758301 [0,1,1,0,0,0|2,0,0]=4 1454 B9R0.46 CCSCCNC(C)CC 2230a_100000209981_100000757381 [0,1,1,0,0,0|2,0,0]=4 1455 B9R0.46 CCSCCNC(C)CO 2230a_100000106463_100012180447 [0,1,1,0,0,0|2,0,0]=4 1456 B9R0.46 CCSCCN[C@H](C)CO 2230a_100000737577_100000757381 [0,1,1,0,0,0|2,0,0]=4 1457 B9R0.46 CCSCCOC(C)CN 34a_100000210904_100000757381 [0,1,1,0,0,0|2,0,0]=4 1458 B9R0.1 CC(C)CCN[C@H](C)CF 269862a_100102880703_100000185833 [0,1,1,0,0,0|2,0,0]=4 1459 B9R0.1 CC(C)CCN[C@H](C)CO 2230a_100000737577_100000210312 [0,1,1,0,0,0|2,0,0]=4 1460 B9R0.1 CC(C)CCN[C@H](C)CO 269862a_100000737577_100000185833 [0,1,1,0,0,0|2,0,0]=4 1461 B9R0.1 CC(C)CCOC(C)CN 34a_100000210904_100000210312 [0,1,1,0,0,0|2,0,0]=4 1462 B9R0.1 CC(CF)OCCN(C)C 7a_100016041109_100000755713 [0,1,1,0,0,0|2,0,0]=4 1463 B9R0.1 CC(CO)SCCN(C)C 62a_100012180447_100000755713 [0,1,1,0,0,0|2,0,0]=4 1464 B9R0.1 CCC(=O)NCCN(C)C 240690a_100000210585_100000210414 [0,1,1,0,0,0|1,0,1]=4 1465 B9R0.1 CCC(=O)NCCN(C)C 527a_100000210585_100000210414 [0,1,1,0,0,0|1,0,1]=4 1466 B9R0.1 CCC(C)NCCC(C)C 2230a_100000209981_100000210312 [0,1,1,0,0,0|2,0,0]=4 1467 B9R0.1 CCC(C)NCCC(C)C 269862a_100000209981_100000185833 [0,1,1,0,0,0|2,0,0]=4 1468 B9R0.1 CCC(C)OCCN(C)C 7a_100000210228_100000755713 [0,1,1,0,0,0|2,0,0]=4 1469 B9R0.1 CCC(C)SCCN(C)C 62a_100000758301_100000755713 [0,1,1,0,0,0|2,0,0]=4 1470 B9R0.1 CN(C)CCNC(=O)CO 240690a_100000210585_100000210174 [0,1,1,0,0,0|1,0,1]=4 1471 B9R0.1 CN(C)CCNC(=O)CO 527a_100000210585_100000210174 [0,1,1,0,0,0|1,0,1]=4 1472 B9R0.1 C[C@H](CO)SCCN(C)C 62a_100016084084_100000755713 [0,1,1,0,0,0|2,0,0]=4 1473 B9R0.4 CC(C)CC(C)NCCF 2230a_100000692259_100011217306 [0,1,1,0,0,0|2,0,0]=4 1474 B9R0.4 CC(C)CC(C)NCCF 34a_100000724931_100000731052 [0,1,1,0,0,0|2,0,0]=4 1475 B9R0.4 CC(C)CC(C)NCCO 2230a_100000692259_100000211926 [0,1,1,0,0,0|2,0,0]=4 1476 B9R0.4 CC(C)CC(C)NCCO 2230a_100016997473_100000731052 [0,1,1,0,0,0|2,0,0]=4 1477 B9R0.4 CC(C)CC(C)NCCO 34a_100016990907_100000731052 [0,1,1,0,0,0|2,0,0]=4 1478 B9R0.4 CC(C)CC(C)OCCN 34a_100000210304_100000731052 [0,1,1,0,0,0|2,0,0]=4 1479 B9R0.4 CC(CN(C)C)SCCF 62a_100011217306_100020606517 [0,1,1,0,0,0|2,0,0]=4 1480 B9R0.4 CC(CN(C)C)SCCF 62a_100020606517_100011217306 [0,1,1,0,0,0|2,0,0]=4 1481 B9R0.4 CC(CN(C)C)SCCO 62a_100000211926_100020606517 [0,1,1,0,0,0|2,0,0]=4 1482 B9R0.4 CC(CN(C)C)SCCO 62a_100020606517_100000211926 [0,1,1,0,0,0|2,0,0]=4 1483 B9R0.4 CCCNC(=O)CN(C)C 11a_100020643023_100000750896 [0,1,1,0,0,0|1,0,1]=4 1484 B9R0.4 CCCNC(=O)CN(C)C 2230a_100000684209_200000210301 [0,1,1,0,0,0|1,0,1]=4 1485 B9R0.4 CCCNC(=O)CN(C)C 2230a_100102631434_100000183358 [0,1,1,0,0,0|1,0,1]=4 1486 B9R0.4 CCCNC(=O)CN(C)C 240690a_100020643023_100000750896 [0,1,1,0,0,0|1,0,1]=4 1487 B9R0.4 CCCNC(=O)CN(C)C 269982a_100000684209_200000210301 [0,1,1,0,0,0|1,0,1]=4 1488 B9R0.4 CCCNC(=O)CN(C)C 269982a_100102631434_100000183358 [0,1,1,0,0,0|1,0,1]=4 1489 B9R0.4 CCCNC(=O)CN(C)C 527a_100020643023_100000750896 [0,1,1,0,0,0|1,0,1]=4 1490 B9R0.4 CCCNC(=O)CN(C)[13CH3] 2230a_100000684209_200025704644 [0,1,1,0,0,0|1,0,1]=4 1491 B9R0.4 CCCNC(=O)CN(C)[13CH3] 269982a_100000684209_200025704644 [0,1,1,0,0,0|1,0,1]=4 1492 B9R0.4 CCCNC(C)CC(C)C 2230a_100000692259_100000210303 [0,1,1,0,0,0|2,0,0]=4 1493 B9R0.4 CCCSC(C)CN(C)C 62a_100000210303_100020606517 [0,1,1,0,0,0|2,0,0]=4 1494 B9R0.4 CCCSC(C)CN(C)C 62a_100020606517_100000210303 [0,1,1,0,0,0|2,0,0]=4 1495 B9R0.4 CN(C)CC(=O)NCCF 11a_100000724931_100000750896 [0,1,1,0,0,0|1,0,1]=4 1496 B9R0.4 CN(C)CC(=O)NCCF 240690a_100000724931_100000750896 [0,1,1,0,0,0|1,0,1]=4 1497 B9R0.4 CN(C)CC(=O)NCCF 527a_100000724931_100000750896 [0,1,1,0,0,0|1,0,1]=4 1498 B9R0.4 CN(C)CC(=O)NCCO 240690a_100000210304_100000750896 [0,1,1,0,0,0|1,0,1]=4 1499 B9R0.4 CN(C)CC(=O)NCCO 527a_100000210304_100000750896 [0,1,1,0,0,0|1,0,1]=4 1500 B9R0.38 CC(C)(C)CCNCCF 2230a_100000738805_100011217306 [0,1,1,0,0,0|2,0,0]=4 1501 B9R0.38 CC(C)(C)CCNCCF 34a_100000724931_100000755188 [0,1,1,0,0,0|2,0,0]=4 1502 B9R0.38 CC(C)(C)CCNCCO 2230a_100000738805_100000211926 [0,1,1,0,0,0|2,0,0]=4 1503 B9R0.38 CC(C)(C)CCNCCO 2230a_100016997473_100000755188 [0,1,1,0,0,0|2,0,0]=4 1504 B9R0.38 CC(C)(C)CCNCCO 34a_100016990907_100000755188 [0,1,1,0,0,0|2,0,0]=4 1505 B9R0.38 CC(C)(C)CCOCCN 34a_100000210304_100000755188 [0,1,1,0,0,0|2,0,0]=4 1506 B9R0.38 CC(C)(F)CCNCCF 2230a_100016253952_100011217306 [0,1,1,0,0,0|2,0,0]=4 1507 B9R0.38 CC(C)(F)CCNCCO 2230a_100016253952_100000211926 [0,1,1,0,0,0|2,0,0]=4 1508 B9R0.38 CC(C)(O)CCNCCF 34a_100000724931_100000702414 [0,1,1,0,0,0|2,0,0]=4 1509 B9R0.38 CC(C)(O)CCNCCO 2230a_100016997473_100000702414 [0,1,1,0,0,0|2,0,0]=4 1510 B9R0.38 CC(C)(O)CCNCCO 34a_100016990907_100000702414 [0,1,1,0,0,0|2,0,0]=4 1511 B9R0.38 CC(C)(O)CCOCCN 34a_100000210304_100000702414 [0,1,1,0,0,0|2,0,0]=4 1512 B9R0.38 CCCNCCC(C)(C)C 2230a_100000738805_100000210303 [0,1,1,0,0,0|2,0,0]=4 1513 B9R0.38 CCCNCCC(C)(C)F 2230a_100016253952_100000210303 [0,1,1,0,0,0|2,0,0]=4 1514 B9R0.38 C[N+](C)(C)CCNCCF 34a_100000724931_100000085578 [0,1,1,0,0,0|1,0,1]=4 1515 B9R0.38 C[N+](C)(C)CCNCCO 34a_100016990907_100000085578 [0,1,1,0,0,0|1,0,1]=4 1516 B9R0.38 C[N+](C)(C)CCOCCN 34a_100000210304_100000085578 [0,1,1,0,0,0|1,0,1]=4 1517 B9R0.38 C[Si](C)(C)CCNCCF 34a_100000724931_200000733723 [0,1,1,0,0,0|2,0,0]=4 1518 B9R0.38 C[Si](C)(C)CCNCCO 2230a_100016997473_200000733723 [0,1,1,0,0,0|2,0,0]=4 1519 B9R0.38 C[Si](C)(C)CCNCCO 34a_100016990907_200000733723 [0,1,1,0,0,0|2,0,0]=4 1520 B9R0.38 C[Si](C)(C)CCOCCN 34a_100000210304_200000733723 [0,1,1,0,0,0|2,0,0]=4 1521 B9R0.47 CC(C)C(O)CNCCF 2230a_100000759067_100011217306 [0,1,1,0,0,0|2,0,0]=4 1522 B9R0.47 CC(C)C(O)CNCCF 34a_100000759067_100011217306 [0,1,1,0,0,0|2,0,0]=4 1523 B9R0.47 CC(C)C(O)CNCCO 2230a_100000759067_100000211926 [0,1,1,0,0,0|2,0,0]=4 1524 B9R0.47 CC(C)C(O)CNCCO 34a_100000759067_100000211926 [0,1,1,0,0,0|2,0,0]=4 1525 B9R0.47 CCCCCC(C)N(C)C 2230a_100102631434_200011218191 [0,1,1,0,0,0|2,0,0]=4 1526 B9R0.47 CCCCCC(C)N(C)C 269982a_100102631434_200011218191 [0,1,1,0,0,0|2,0,0]=4 1527 B9R0.47 CCCCCC(C)N(C)C 270004a_100102631434_100000211708 [0,1,1,0,0,0|2,0,0]=4 1528 B9R0.47 CCCNCC(=O)N(C)C 2230a_100015183351_100000210303 [0,1,1,0,0,0|1,0,1]=4 1529 B9R0.47 CCCNCC(O)C(C)C 2230a_100000759067_100000210303 [0,1,1,0,0,0|2,0,0]=4 1530 B9R0.47 CCCNCC(O)C(C)C 34a_100000759067_100000210303 [0,1,1,0,0,0|2,0,0]=4 1531 B9R0.47 CCCSCC(C)N(C)C 270004a_100102631434_100011343953 [0,1,1,0,0,0|2,0,0]=4 1532 B9R0.47 CN(C)C(=O)CNCCF 2230a_100015183351_100011217306 [0,1,1,0,0,0|1,0,1]=4 1533 B9R0.47 CN(C)C(=O)CNCCF 34a_100000724931_100000692301 [0,1,1,0,0,0|1,0,1]=4 1534 B9R0.47 CN(C)C(=O)CNCCO 2230a_100015183351_100000211926 [0,1,1,0,0,0|1,0,1]=4 1535 B9R0.47 CN(C)C(=O)CNCCO 2230a_100016997473_100000185267 [0,1,1,0,0,0|1,0,1]=4 1536 B9R0.47 CN(C)C(=O)CNCCO 34a_100016990907_100000692301 [0,1,1,0,0,0|1,0,1]=4 1537 B9R0.47 CN(C)C(=O)COCCN 34a_100000210304_100000692301 [0,1,1,0,0,0|1,0,1]=4 1538 B9R0.48 C=CCN(C)CCN(C)C 269982a_100000225617_100000755713 [0,1,1,0,0,0|1,0,1]=4 1539 B9R0.48 C=CCN(C)CCN(C)C 269982a_100000225618_100000210623 [0,1,1,0,0,0|1,0,1]=4 1540 B9R0.48 CC(C)CCN(C)CCF 2230a_100000742789_100011217306 [0,1,1,0,0,0|2,0,0]=4 1541 B9R0.48 CC(C)CCN(C)CCF 269982a_100000742789_100011217306 [0,1,1,0,0,0|2,0,0]=4 1542 B9R0.48 CC(C)CCN(C)CCO 2230a_100000210263_100000210312 [0,1,1,0,0,0|2,0,0]=4 1543 B9R0.48 CC(C)CCN(C)CCO 2230a_100000742789_100000211926 [0,1,1,0,0,0|2,0,0]=4 1544 B9R0.48 CC(C)CCN(C)CCO 269982a_100000210263_100000210312 [0,1,1,0,0,0|2,0,0]=4 1545 B9R0.48 CC(C)CCN(C)CCO 269982a_100000742789_100000211926 [0,1,1,0,0,0|2,0,0]=4 1546 B9R0.48 CCCN(C)CCC(C)C 2230a_100000742789_100000210303 [0,1,1,0,0,0|2,0,0]=4 1547 B9R0.48 CCCN(C)CCC(C)C 2230a_100000747261_100000210312 [0,1,1,0,0,0|2,0,0]=4 1548 B9R0.48 CCCN(C)CCC(C)C 269982a_100000742789_100000210303 [0,1,1,0,0,0|2,0,0]=4 1549 B9R0.48 CCCN(C)CCC(C)C 269982a_100000747261_100000210312 [0,1,1,0,0,0|2,0,0]=4 1550 B9R0.48 CCCN(C)CCN(C)C 2230a_100000226821_200000210301 [0,1,1,0,0,0|1,0,0]=3 1551 B9R0.48 CCCN(C)CCN(C)C 269982a_100000225618_100000210303 [0,1,1,0,0,0|1,0,0]=3 1552 B9R0.48 CCCN(C)CCN(C)C 269982a_100000226821_200000210301 [0,1,1,0,0,0|1,0,0]=3 1553 B9R0.48 CCCN(C)CCN(C)C 269982a_100000747261_100000755713 [0,1,1,0,0,0|1,0,0]=3 1554 B9R0.48 CCCN([13CH3])CCN(C)C 2230a_100000226821_200025704644 [0,1,1,0,0,0|1,0,0]=3 1555 B9R0.48 CCCN([13CH3])CCN(C)C 269982a_100000226821_200025704644 [0,1,1,0,0,0|1,0,0]=3 1556 B9R0.48 CN(C)CCN(C)CC#N 269982a_100000225618_100011214920 [0,1,1,0,0,0|0,0,2]=4 1557 B9R0.48 CN(C)CCN(C)CC=O 269982a_100000225618_200015260668 [0,1,1,0,0,0|1,0,1]=4 1558 B9R0.48 CN(C)CCN(C)CCF 269982a_100000225618_100011217306 [0,1,1,0,0,0|1,0,0]=3 1559 B9R0.48 CN(C)CCN(C)CCO 269982a_100000210263_100000755713 [0,1,1,0,0,0|1,0,0]=3 1560 B9R0.48 CN(C)CCN(C)CCO 269982a_100000225618_100000211926 [0,1,1,0,0,0|1,0,0]=3 1561 B9R0.48 COCN(C)CCN(C)C 269982a_100000225618_100000766300 [0,1,1,0,0,0|2,0,0]=4 1562 B9R0.48 CSCN(C)CCN(C)C 269982a_100000225618_100011218213 [0,1,1,0,0,0|2,0,0]=4 1563 B9R0.55 CC(C)CCCCN(C)C 2230a_100102631434_100011216152 [0,1,1,0,0,0|2,0,0]=4 1564 B9R0.55 CC(C)CCCCN(C)C 269982a_100102631434_100011216152 [0,1,1,0,0,0|2,0,0]=4 1565 B9R0.55 CC(C)CCNCC(=O)N 2230a_100000711301_100000210312 [0,1,1,0,0,0|1,0,1]=4 1566 B9R0.55 CC(C)CCNCC(C)C 2230a_100000210953_100000210312 [0,1,1,0,0,0|2,0,0]=4 1567 B9R0.55 CC(C)CCNCC(C)C 269862a_100000210953_100000185833 [0,1,1,0,0,0|2,0,0]=4 1568 B9R0.55 CC(C)CCNCC(C)C 270004a_100000210545_100000210432 [0,1,1,0,0,0|2,0,0]=4 1569 B9R0.55 CC(C)CCNCC(C)C 34a_100000210953_100000210312 [0,1,1,0,0,0|2,0,0]=4 1570 B9R0.55 CC(C)CCNCC(C)O 2230a_100000210904_100000210312 [0,1,1,0,0,0|2,0,0]=4 1571 B9R0.55 CC(C)CCNCC(C)O 269862a_100000210904_100000185833 [0,1,1,0,0,0|2,0,0]=4 1572 B9R0.55 CC(C)CCNCC(C)O 34a_100000210904_100000210312 [0,1,1,0,0,0|2,0,0]=4 1573 B9R0.55 CC(C)CCNCC(F)F 34a_100000765723_100000210312 [0,1,1,0,0,0|2,0,0]=4 1574 B9R0.55 CC(C)CCOC[C@@H](C)N 34a_100000737577_100000210312 [0,1,1,0,0,0|2,0,0]=4 1575 B9R0.55 CC(C)CNCCN(C)C 270004a_100000210585_100000210432 [0,1,1,0,0,0|1,0,0]=3 1576 B9R0.55 CC(C)CSCCN(C)C 62a_100000210624_100000755713 [0,1,1,0,0,0|2,0,0]=4 1577 B9R0.55 CC(O)CSCCN(C)C 62a_100011218427_100000755713 [0,1,1,0,0,0|2,0,0]=4 1578 B9R0.55 CN(C)CCNCC(=O)O 269956a_100016091260_100000755713 [0,1,1,0,0,0|1,0,1]=4 1579 B9R0.55 CN(C)CCOCC(=O)N 2230a_100102631434_100000076697 [0,1,1,0,0,0|1,0,1]=4 1580 B9R0.55 CN(C)CCOCC(=O)N 269982a_100102631434_100000076697 [0,1,1,0,0,0|1,0,1]=4 1581 B9R0.55 CN(C)CCOCC(F)F 2230a_100102631434_200012177212 [0,1,1,0,0,0|2,0,0]=4 1582 B9R0.55 CN(C)CCSCC(=O)N 62a_100000747473_100000755713 [0,1,1,0,0,0|1,0,1]=4 1583 B9R0.55 CN(C)CCSCC(F)F 62a_100011934356_100000755713 [0,1,1,0,0,0|2,0,0]=4 1584 B9R0.55 C[C@@H](O)CSCCN(C)C 62a_100009817552_100000755713 [0,1,1,0,0,0|2,0,0]=4 1585 B9R1.75 CCCN(C)CC1CC1 2230a_100000210729_200000210301 [1,1,0,0,0,0|2,0,0]=4 1586 B9R1.75 CCCN(C)CC1CC1 2230a_100000741881_100000210303 [1,1,0,0,0,0|2,0,0]=4 1587 B9R1.75 CCCN(C)CC1CC1 2230a_100000747261_100000742324 [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.75 CCCN(C)CC1CC1 269982a_100000210729_200000210301 [1,1,0,0,0,0|2,0,0]=4 1589 B9R1.75 CCCN(C)CC1CC1 269982a_100000741881_100000210303 [1,1,0,0,0,0|2,0,0]=4 1590 B9R1.75 CCCN(C)CC1CC1 269982a_100000747261_100000756562 [1,1,0,0,0,0|2,0,0]=4 1591 B9R1.75 CCCN(C)CC1CC1 34a_100000210729_200000210301 [1,1,0,0,0,0|2,0,0]=4 1592 B9R1.75 CCCN([13CH3])CC1CC1 2230a_100000210729_200025704644 [1,1,0,0,0,0|2,0,0]=4 1593 B9R1.75 CCCN([13CH3])CC1CC1 269982a_100000210729_200025704644 [1,1,0,0,0,0|2,0,0]=4 1594 B9R1.75 CCCN([13CH3])CC1CC1 34a_100000210729_200025704644 [1,1,0,0,0,0|2,0,0]=4 1595 B9R1.75 CCNC(=O)CC1CC1 11a_100015525214_100000738066 [1,1,0,0,0,0|1,0,1]=4 1596 B9R1.75 CCNC(=O)CC1CC1 240690a_100015525214_100000738066 [1,1,0,0,0,0|1,0,1]=4 1597 B9R1.75 CCNC(=O)CC1CC1 527a_100015525214_100000738066 [1,1,0,0,0,0|1,0,1]=4 1598 B9R1.75 CCNC(C)CC1CC1 270004a_100015525214_200000686933 [1,1,0,0,0,0|1,0,0]=3 1599 B9R1.75 CN(CCF)CC1CC1 2230a_100000741881_100011217306 [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.75 CN(CCF)CC1CC1 269982a_100000741881_100011217306 [1,1,0,0,0,0|2,0,0]=4 1601 B9R1.75 CN(CCO)CC1CC1 2230a_100000210263_100000742324 [1,1,0,0,0,0|2,0,0]=4 1602 B9R1.75 CN(CCO)CC1CC1 2230a_100000741881_100000211926 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.75 CN(CCO)CC1CC1 269982a_100000210263_100000756562 [1,1,0,0,0,0|2,0,0]=4 1604 B9R1.75 CN(CCO)CC1CC1 269982a_100000741881_100000211926 [1,1,0,0,0,0|2,0,0]=4 1605 B9R1.80 CC(CN)COC1CC1 34a_100000744482_100000211595 [1,1,0,0,0,0|2,0,0]=4 1606 B9R1.80 CC(CN)OCC1CC1 34a_100000210904_100000742324 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.80 CC(CO)NCC1CC1 2230a_100000735609_100012180447 [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.80 CC(CO)NCC1CC1 34a_100000735609_100012180447 [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.80 CCC(=O)CCC1CC1 1458a_100000210414_100000694398 [1,1,0,0,0,0|2,0,0]=4 1610 B9R1.80 CCC(=O)CCC1CC1 1458a_100000756386_100000210202 [1,1,0,0,0,0|2,0,0]=4 1611 B9R1.80 CCC(C)NCC1CC1 2230a_100000209981_100000742324 [1,1,0,0,0,0|2,0,0]=4 1612 B9R1.80 CCC(C)NCC1CC1 2230a_100000735609_100000758301 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.80 CCC(C)NCC1CC1 269862a_100000209981_100000741477 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.80 CCC(C)NCC1CC1 34a_100000735609_100011215416 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.80 CCN(C)CCC1CC1 2230a_100000225621_100000694398 [1,1,0,0,0,0|1,0,0]=3 1616 B9R1.80 CCN(C)CCC1CC1 269982a_100000225621_100000694398 [1,1,0,0,0,0|1,0,0]=3 1617 B9R1.80 CCN(C)CCC1CO1 2230a_100000225621_100000732470 [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.80 CCN(C)CCC1CO1 269982a_100000225621_100000732470 [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.80 C[C@H](CF)NCC1CC1 269862a_100102880703_100000741477 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.80 C[C@H](CO)NCC1CC1 2230a_100000737577_100000742324 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.80 C[C@H](CO)NCC1CC1 269862a_100000737577_100000741477 [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.80 NC[C@@H](F)COC1CC1 34a_100015665980_100000211595 [1,1,0,0,0,0|2,0,0]=4 1623 B9R1.85 CC(=O)NCCC1CC1 1626a_100000764129_100015343762 [1,1,0,0,0,0|1,0,1]=4 1624 B9R1.85 CC(=O)NCCC1CC1 240690a_100000764129_100015343762 [1,1,0,0,0,0|1,0,1]=4 1625 B9R1.85 CC(=O)NCCC1CC1 527a_100000764129_100103153847 [1,1,0,0,0,0|1,0,1]=4 1626 B9R1.85 CC(C)CNCC1CC1 2230a_100000210953_100000742324 [1,1,0,0,0,0|2,0,0]=4 1627 B9R1.85 CC(C)CNCC1CC1 2230a_100000735609_100000210760 [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.85 CC(C)CNCC1CC1 269862a_100000210953_100000741477 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.85 CC(C)CNCC1CC1 270004a_100000735609_100000210432 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.85 CC(C)CNCC1CC1 34a_100000210953_100000742324 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.85 CC(C)CNCC1CC1 34a_100000735609_100000210624 [1,1,0,0,0,0|2,0,0]=4 1632 B9R1.85 CC(C)NCCC1CC1 2230a_100138425928_100000694398 [1,1,0,0,0,0|1,0,0]=3 1633 B9R1.85 CC(C)NCCC1CC1 34a_100000764129_100000210206 [1,1,0,0,0,0|1,0,0]=3 1634 B9R1.85 CC(C)NCCC1CC1 34a_100138425928_100000694398 [1,1,0,0,0,0|1,0,0]=3 1635 B9R1.85 CC(C)NCCC1CO1 2230a_100138425928_100000732470 [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.85 CC(C)NCCC1CO1 34a_100138425928_100000732470 [1,1,0,0,0,0|2,0,0]=4 1637 B9R1.85 CC(C)OCCC1CC1 34a_100000212225_100000694398 [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.85 CC(C)OCCC1CC1 34a_100000754188_100000210206 [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.85 CC(C)OCCC1CC1 7a_100000754188_100000210206 [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.85 CC(C)SCCC1CC1 62a_100000210206_100000764125 [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.85 CC(C)SCCC1CC1 62a_100000764125_100000210206 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.85 CC(O)CNCC1CC1 2230a_100000210904_100000742324 [1,1,0,0,0,0|2,0,0]=4 1643 B9R1.85 CC(O)CNCC1CC1 2230a_100000735609_100011218427 [1,1,0,0,0,0|2,0,0]=4 1644 B9R1.85 CC(O)CNCC1CC1 269862a_100000210904_100000741477 [1,1,0,0,0,0|2,0,0]=4 1645 B9R1.85 CC(O)CNCC1CC1 34a_100000210904_100000742324 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.85 CC(O)CNCC1CC1 34a_100000735609_100011218427 [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.85 C[C@@H](N)CCOC1CC1 34a_100000706166_100000211595 [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.85 C[C@@H](N)COCC1CC1 34a_100000737577_100000742324 [1,1,0,0,0,0|2,0,0]=4 1649 B9R1.85 C[C@@H](O)CNCC1CC1 2230a_100000735609_100009817552 [1,1,0,0,0,0|2,0,0]=4 1650 B9R1.85 C[C@@H](O)CNCC1CC1 34a_100000735609_100009817552 [1,1,0,0,0,0|2,0,0]=4 1651 B9R1.85 FC(F)CNCC1CC1 2230a_100000735609_100011934356 [1,1,0,0,0,0|2,0,0]=4 1652 B9R1.85 FC(F)CNCC1CC1 34a_100000735609_100011934356 [1,1,0,0,0,0|2,0,0]=4 1653 B9R1.85 FC(F)CNCC1CC1 34a_100000765723_100000742324 [1,1,0,0,0,0|2,0,0]=4 1654 B9R1.85 NC(=O)CNCC1CC1 2230a_100000711301_100000742324 [1,1,0,0,0,0|1,0,1]=4 1655 B9R1.85 NC(=O)CNCC1CC1 2230a_100000735609_100000747473 [1,1,0,0,0,0|1,0,1]=4 1656 B9R1.85 NC(=O)CNCC1CC1 34a_100000735609_100000187820 [1,1,0,0,0,0|1,0,1]=4 1657 B9R1.99 CC1(CC1)CNCCF 2230a_100000766693_100011217306 [1,1,0,0,0,0|2,0,0]=4 1658 B9R1.99 CC1(CC1)CNCCO 2230a_100000766693_100000211926 [1,1,0,0,0,0|2,0,0]=4 1659 B9R1.99 CCCNCC1(CC1)C 2230a_100000766693_100000210303 [1,1,0,0,0,0|2,0,0]=4 1660 B9R1.99 CCCNCC1(CC1)O 2230a_100011936951_100000210303 [1,1,0,0,0,0|2,0,0]=4 1661 B9R1.99 OC1(CC1)CNCCF 2230a_100011936951_100011217306 [1,1,0,0,0,0|2,0,0]=4 1662 B9R1.99 OCCNCC1(CC1)O 2230a_100011936951_100000211926 [1,1,0,0,0,0|2,0,0]=4 1663 B9R1.100 CC(NCCF)C1CC1 2230a_100000700016_100011217306 [1,1,0,0,0,0|2,0,0]=4 1664 B9R1.100 CC(NCCF)C1CC1 269862a_100000724931_100000210639 [1,1,0,0,0,0|2,0,0]=4 1665 B9R1.100 CC(NCCF)C1CC1 34a_100000700016_100011217306 [1,1,0,0,0,0|2,0,0]=4 1666 B9R1.100 CC(NCCO)C1CC1 2230a_100000700016_100000211926 [1,1,0,0,0,0|2,0,0]=4 1667 B9R1.100 CC(NCCO)C1CC1 269862a_100000210304_100000210639 [1,1,0,0,0,0|2,0,0]=4 1668 B9R1.100 CC(NCCO)C1CC1 34a_100000700016_100000211926 [1,1,0,0,0,0|2,0,0]=4 1669 B9R1.100 CCCNC(C)C1CC1 2230a_100000700016_100000210303 [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.100 CCCNC(C)C1CC1 269862a_100020643023_100000210639 [1,1,0,0,0,0|2,0,0]=4 1671 B9R1.100 CCCNC(C)C1CC1 34a_100000700016_100000210303 [1,1,0,0,0,0|2,0,0]=4 1672 B9R1.100 CCNCC(=O)C1CC1 2230a_100015525214_100000746382 [1,1,0,0,0,0|1,0,1]=4 1673 B9R1.100 CCNCC(O)C1CC1 2230a_100000751198_100000210202 [1,1,0,0,0,0|1,0,0]=3 1674 B9R1.100 CCNCC(O)C1CC1 34a_100000751198_100000210202 [1,1,0,0,0,0|1,0,0]=3 1675 B9R1.100 CCOC[C@H](N)C1CC1 34a_100020623730_100000210202 [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.100 OC(CNCF)C1CC1 34a_100000751198_100015361967 [1,1,0,0,0,0|2,0,0]=4 1677 B11R1.47 C#CCCCCCN1CCC1 269982a_100000754969_100012094781 [0,1,0,0,0,1|2,0,0]=4 1678 B11R1.47 C=CCCCCCN1CCC1 269982a_100000754969_100000700193 [0,1,0,0,0,1|2,0,0]=4 1679 B11R1.47 CCCCCCCN1CCC1 269982a_100000754969_100000210681 [0,1,0,0,0,1|2,0,0]=4 1680 B11R1.47 CCCCOCCN1CCC1 269982a_100000754969_100000743108 [0,1,0,0,0,1|2,0,0]=4 1681 B11R1.47 COCCOCCN1CCC1 269982a_100000754969_100000695917 [0,1,0,0,0,1|2,0,0]=4 1682 B11R1.47 FCCCCCCN1CCC1 269982a_100000754969_100015922095 [0,1,0,0,0,1|2,0,0]=4 1683 B11R1.47 N#CCCCCCN1CCC1 269982a_100000754969_100009813376 [0,1,0,0,0,1|1,0,1]=4 1684 B11R1.47 NCCCCCOC1CCC1 34a_100000762737_100000749161 [0,1,0,0,0,1|2,0,0]=4 1685 B11R1.47 NCCCCCOC1COC1 34a_100000762737_100009818527 [0,1,0,0,0,1|2,0,0]=4 1686 B11R1.47 NCCCCOCC1CCC1 34a_100000750430_100000763275 [0,1,0,0,0,1|2,0,0]=4 1687 B11R1.47 NCCCCOCC1CCO1 34a_100000750430_100000103362 [0,1,0,0,0,1|2,0,0]=4 1688 B11R1.47 NCCCCOCC1COC1 34a_100000750430_100010264016 [0,1,0,0,0,1|2,0,0]=4 1689 B11R1.47 NCCOCCOC1CCC1 34a_100000211614_100000749161 [0,1,0,0,0,1|2,0,0]=4 1690 B11R1.47 NCCOCCOC1COC1 34a_100000211614_100009818527 [0,1,0,0,0,1|2,0,0]=4 1691 B11R1.47 O=CCCCCCN1CCC1 269982a_100000754969_100000139337 [0,1,0,0,0,1|2,0,0]=4 1692 B11R1.47 OCCCCCCN1CCC1 269982a_100000754969_100000766143 [0,1,0,0,0,1|2,0,0]=4 1693 B11R1.78 CC1CN(C1)CCCCCF 2230a_100000702820_100000729378 [0,1,0,0,0,1|2,0,0]=4 1694 B11R1.78 CC1CN(C1)CCCCCF 269982a_100000702820_100000729378 [0,1,0,0,0,1|2,0,0]=4 1695 B11R1.78 CC1CN(C1)CCCCCF 34a_100000702820_100000729378 [0,1,0,0,0,1|2,0,0]=4 1696 B11R1.78 CC1CN(C1)CCCCCO 2230a_100000702820_100000746330 [0,1,0,0,0,1|2,0,0]=4 1697 B11R1.78 CC1CN(C1)CCCCCO 269982a_100000702820_100000746330 [0,1,0,0,0,1|2,0,0]=4 1698 B11R1.78 CC1CN(C1)CCCCCO 34a_100000702820_100000746330 [0,1,0,0,0,1|2,0,0]=4 1699 B11R1.78 CC1CN(C1)CCOCCO 2230a_100000702820_100011215305 [0,1,0,0,0,1|2,0,0]=4 1700 B11R1.78 CC1CN(C1)CCOCCO 269982a_100000702820_100011215305 [0,1,0,0,0,1|2,0,0]=4 1701 B11R1.78 CC1CN(C1)CCOCCO 34a_100000702820_100000692535 [0,1,0,0,0,1|2,0,0]=4 1702 B11R1.78 CCCCCCN1CC(C1)C 2230a_100000702820_100000210314 [0,1,0,0,0,1|2,0,0]=4 1703 B11R1.78 CCCCCCN1CC(C1)C 269982a_100000702820_100000210757 [0,1,0,0,0,1|2,0,0]=4 1704 B11R1.78 CCCCCCN1CC(C1)C 34a_100000702820_100000210314 [0,1,0,0,0,1|2,0,0]=4 1705 B11R1.78 CCCCCCN1CC(C1)F 2230a_100000690557_100000210314 [0,1,0,0,0,1|2,0,0]=4 1706 B11R1.78 CCCCCCN1CC(C1)F 269982a_100000690557_100000210757 [0,1,0,0,0,1|2,0,0]=4 1707 B11R1.78 CCCCCCN1CC(C1)F 34a_100000690557_100000210314 [0,1,0,0,0,1|2,0,0]=4 1708 B11R1.78 CCCCCCN1CC(C1)O 269982a_100000749847_100000210757 [0,1,0,0,0,1|2,0,0]=4 1709 B11R1.78 CCCOCCN1CC(C1)C 2230a_100000702820_100011215938 [0,1,0,0,0,1|2,0,0]=4 1710 B11R1.78 CCCOCCN1CC(C1)C 269982a_100000702820_100011215938 [0,1,0,0,0,1|2,0,0]=4 1711 B11R1.78 CCCOCCN1CC(C1)C 34a_100000702820_100011215938 [0,1,0,0,0,1|2,0,0]=4 1712 B11R1.78 CCCOCCN1CC(C1)F 2230a_100000690557_100011215938 [0,1,0,0,0,1|2,0,0]=4 1713 B11R1.78 CCCOCCN1CC(C1)F 269982a_100000690557_100011215938 [0,1,0,0,0,1|2,0,0]=4 1714 B11R1.78 CCCOCCN1CC(C1)F 34a_100000690557_100011215938 [0,1,0,0,0,1|2,0,0]=4 1715 B11R1.78 CCCOCCN1CC(C1)O 269982a_100000749847_100011215938 [0,1,0,0,0,1|2,0,0]=4 1716 B11R1.78 FCCCCCN1CC(C1)F 2230a_100000690557_100000729378 [0,1,0,0,0,1|2,0,0]=4 1717 B11R1.78 FCCCCCN1CC(C1)F 269982a_100000690557_100000729378 [0,1,0,0,0,1|2,0,0]=4 1718 B11R1.78 FCCCCCN1CC(C1)F 34a_100000690557_100000729378 [0,1,0,0,0,1|2,0,0]=4 1719 B11R1.78 OC1CN(C1)CCCCCF 269982a_100000749847_100000729378 [0,1,0,0,0,1|2,0,0]=4 1720 B11R1.78 OCCCCCN1CC(C1)F 2230a_100000690557_100000746330 [0,1,0,0,0,1|2,0,0]=4 1721 B11R1.78 OCCCCCN1CC(C1)F 269982a_100000690557_100000746330 [0,1,0,0,0,1|2,0,0]=4 1722 B11R1.78 OCCCCCN1CC(C1)F 34a_100000690557_100000746330 [0,1,0,0,0,1|2,0,0]=4 1723 B11R1.78 OCCCCCN1CC(C1)O 269982a_100000749847_100000746330 [0,1,0,0,0,1|2,0,0]=4 1724 B11R1.78 OCCOCCN1CC(C1)F 2230a_100000690557_100011215305 [0,1,0,0,0,1|2,0,0]=4 1725 B11R1.78 OCCOCCN1CC(C1)F 269982a_100000690557_100011215305 [0,1,0,0,0,1|2,0,0]=4 1726 B11R1.78 OCCOCCN1CC(C1)F 34a_100000690557_100000692535 [0,1,0,0,0,1|2,0,0]=4 1727 B11R1.78 OCCOCCN1CC(C1)O 269982a_100000749847_100011215305 [0,1,0,0,0,1|2,0,0]=4 1728 B11R1.174 CC(C)CCCCN1CCC1 269982a_100000754969_100011216152 [0,1,0,0,0,1|2,0,0]=4 1729 B11R1.174 NC(=O)COCCN1CCC1 269982a_100000754969_100000076697 [0,1,0,0,0,1|1,0,1]=4 1730 B11R1.190 CC1CCN1CCCCCF 269982a_100000755817_100000729378 [0,1,0,0,0,1|2,0,0]=4 1731 B11R1.190 CC1CCN1CCCCCF 34a_100000755817_100000729378 [0,1,0,0,0,1|2,0,0]=4 1732 B11R1.190 CC1CCN1CCCCCO 269982a_100000755817_100000746330 [0,1,0,0,0,1|2,0,0]=4 1733 B11R1.190 CC1CCN1CCCCCO 34a_100000755817_100000746330 [0,1,0,0,0,1|2,0,0]=4 1734 B11R1.190 CC1CCN1CCOCCO 269982a_100000755817_100011215305 [0,1,0,0,0,1|2,0,0]=4 1735 B11R1.190 CC1CCN1CCOCCO 34a_100000755817_100000692535 [0,1,0,0,0,1|2,0,0]=4 1736 B11R1.190 CCCCCCN1CCC1C 269982a_100000755817_100000210757 [0,1,0,0,0,1|2,0,0]=4 1737 B11R1.190 CCCCCCN1CCC1C 34a_100000755817_100000210314 [0,1,0,0,0,1|2,0,0]=4 1738 B11R1.190 CCCOCCN1CCC1C 269982a_100000755817_100011215938 [0,1,0,0,0,1|2,0,0]=4 1739 B11R1.190 CCCOCCN1CCC1C 34a_100000755817_100011215938 [0,1,0,0,0,1|2,0,0]=4 1740 B11R1.190 O=C1CCC1CCNCCO 2230a_100016997473_200016118888 [0,1,0,0,0,1|2,0,0]=4 1741 B11R1.236 CCC(=O)NCCN1CCC1 240690a_100000691440_100000210414 [0,1,0,0,0,1|1,0,1]=4 1742 B11R1.236 O=C(CO)NCCN1CCC1 240690a_100000691440_100000210174 [0,1,0,0,0,1|1,0,1]=4 1743 B11R1.284 CCCNC(=O)CN1CCC1 269982a_100000754969_100000183358 [0,1,0,0,0,1|1,0,1]=4 1744 B11R1.299 CCCCCC(C)N1CCC1 269982a_100000754969_200011218191 [0,1,0,0,0,1|2,0,0]=4 1745 B11R1.299 NCCOCC(=O)N1CCC1 34a_100000210304_100000185095 [0,1,0,0,0,1|1,0,1]=4 1746 B11R1.299 O=C(CNCCF)N1CCC1 34a_100000724931_100000185095 [0,1,0,0,0,1|1,0,1]=4 1747 B11R1.299 O=C(CNCCO)N1CCC1 2230a_100016997473_100000185095 [0,1,0,0,0,1|1,0,1]=4 1748 B11R1.299 O=C(CNCCO)N1CCC1 34a_100016990907_100000185095 [0,1,0,0,0,1|1,0,1]=4 1749 B11R1.237 C=CC(O)CNCCC1CC1 34a_100000764129_100000730141 [0,2,0,0,0,0|2,0,0]=4 1750 B11R1.237 C=C[C@H](N)COCCC1CC1 34a_100016989147_100000694398 [0,2,0,0,0,0|2,0,0]=4 1751 B11R1.237 CC(CN)COCCC1CC1 34a_100000744482_100000694398 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.237 CC(CO)CNCCC1CC1 34a_100000744482_100000694398 [0,2,0,0,0,0|2,0,0]=4 1753 B11R1.237 CCC(C)CNCCC1CC1 2230a_100020588543_100000694398 [0,2,0,0,0,0|2,0,0]=4 1754 B11R1.237 CCC(C)CNCCC1CC1 270004a_100000764129_100000243153 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.237 CCC(C)CNCCC1CC1 34a_100000764129_100000748023 [0,2,0,0,0,0|2,0,0]=4 1756 B11R1.237 CCC(O)CNCCC1CC1 2230a_100011218483_100000694398 [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.237 CCC(O)CNCCC1CC1 34a_100000764129_100011218378 [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.237 CC[C@H](C)CNCCC1CC1 34a_100000764129_100009816398 [0,2,0,0,0,0|2,0,0]=4 1759 B11R1.237 CNC(=O)CNCCC1CC1 2230a_100000693194_100000694398 [0,2,0,0,0,0|1,0,1]=4 1760 B11R1.237 CNC(=O)CNCCC1CC1 34a_100000764129_100000183359 [0,2,0,0,0,0|1,0,1]=4 1761 B11R1.237 CO[C@H](C)CNCCC1CC1 2230a_100020591295_100000694398 [0,2,0,0,0,0|2,0,0]=4 1762 B11R1.237 C[C@@H](CN)CCCOC1CC1 34a_100160569302_100000211595 [0,2,0,0,0,0|2,0,0]=4 1763 B11R1.237 C[C@@H](CO)CNCCC1CC1 34a_100000764129_100000059175 [0,2,0,0,0,0|2,0,0]=4 1764 B11R1.237 NC[C@@H](F)COCCC1CC1 34a_100015665980_100000694398 [0,2,0,0,0,0|2,0,0]=4 1765 B11R1.237 OCC(O)CNCCC1CC1 34a_100000764129_100011219619 [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.237 OC[C@@H](O)CNCCC1CC1 2230a_100020644852_100000694398 [0,2,0,0,0,0|2,0,0]=4 1767 B11R1.237 OC[C@H](F)CNCCC1CC1 34a_100015665980_100000694398 [0,2,0,0,0,0|2,0,0]=4 1768 B11R1.237 OC[C@H](O)CNCCC1CC1 34a_100000764129_100009815848 [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.237 O[C@@H](CF)CNCCC1CC1 34a_100000764129_100015614560 [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.333 CC(C)C(C)NCCC1CC1 2230a_100000211541_100000694398 [0,2,0,0,0,0|2,0,0]=4 1771 B11R1.333 CC(NCCC1CC1)C(=O)N 34a_100000764129_100000702099 [0,2,0,0,0,0|1,0,1]=4 1772 B11R1.333 C[C@@H](NCCC1CC1)C(=O)N 2230a_100000119354_100000694398 [0,2,0,0,0,0|1,0,1]=4 1773 B11R1.333 C[C@@H](NCCC1CC1)C(=O)N 34a_100000119354_100000694398 [0,2,0,0,0,0|1,0,1]=4 1774 B11R1.333 NC(=O)C(F)NCCC1CC1 34a_100000764129_100009813875 [0,2,0,0,0,0|1,0,1]=4 1775 B11R1.343 CC(C)(C)CNCCC1CC1 2230a_100000743828_100000694398 [0,2,0,0,0,0|2,0,0]=4 1776 B11R1.343 CC(C)(C)CNCCC1CC1 270004a_100000764129_100011204126 [0,2,0,0,0,0|2,0,0]=4 1777 B11R1.343 CC(C)(C)CNCCC1CC1 34a_100000764129_100011219605 [0,2,0,0,0,0|2,0,0]=4 1778 B11R1.343 CC(C)(F)CNCCC1CC1 2230a_100020643315_100000694398 [0,2,0,0,0,0|2,0,0]=4 1779 B11R1.343 CC(C)(F)CNCCC1CC1 34a_100000764129_100011997219 [0,2,0,0,0,0|2,0,0]=4 1780 B11R1.343 CC(C)(O)CNCCC1CC1 2230a_100000751335_100000694398 [0,2,0,0,0,0|2,0,0]=4 1781 B11R1.343 CC(C)(O)CNCCC1CC1 34a_100000764129_100000764493 [0,2,0,0,0,0|2,0,0]=4 1782 B11R1.343 FC(F)(F)CNCCC1CC1 34a_100000717047_100000694398 [0,2,0,0,0,0|2,0,0]=4 1783 B11R1.348 CC(C)CNC(C)CC1CC1 270004a_100000210953_200000686933 [0,2,0,0,0,0|2,0,0]=4 1784 B11R1.348 CC(CC1CC1)NCC(F)F 270004a_100000765723_200000686933 [0,2,0,0,0,0|2,0,0]=4 1785 B11R1.348 CC(O)CNC(C)CC1CC1 270004a_100000210904_200000686933 [0,2,0,0,0,0|2,0,0]=4 1786 B11R1.485 CC(C)CN(C)CCC1CC1 2230a_100000747067_100000694398 [0,2,0,0,0,0|2,0,0]=4 1787 B11R1.485 CC(C)CN(C)CCC1CC1 269982a_100000747067_100000694398 [0,2,0,0,0,0|2,0,0]=4 1788 B11R1.485 CC(O)CN(C)CCC1CC1 2230a_100000227577_100000694398 [0,2,0,0,0,0|2,0,0]=4 1789 B11R1.485 CC(O)CN(C)CCC1CC1 269982a_100000227577_100000694398 [0,2,0,0,0,0|2,0,0]=4 1790 B11R1.485 CN(CCC1CC1)CC(=O)N 2230a_100000739694_100000694398 [0,2,0,0,0,0|1,0,1]=4 1791 B11R1.720 CC(C)CNCC(O)C1CC1 2230a_100000751198_100000210760 [0,2,0,0,0,0|2,0,0]=4 1792 B11R1.720 CC(C)CNCC(O)C1CC1 270004a_100000751198_100000210432 [0,2,0,0,0,0|2,0,0]=4 1793 B11R1.720 CC(C)CNCC(O)C1CC1 34a_100000751198_100000210624 [0,2,0,0,0,0|2,0,0]=4 1794 B11R1.720 CC(O)CNCC(O)C1CC1 2230a_100000751198_100011218427 [0,2,0,0,0,0|2,0,0]=4 1795 B11R1.720 CC(O)CNCC(O)C1CC1 34a_100000751198_100011218427 [0,2,0,0,0,0|2,0,0]=4 1796 B11R1.720 C[C@@H](O)CNCC(O)C1CC1 2230a_100000751198_100009817552 [0,2,0,0,0,0|2,0,0]=4 1797 B11R1.720 C[C@@H](O)CNCC(O)C1CC1 34a_100000751198_100009817552 [0,2,0,0,0,0|2,0,0]=4 1798 B11R1.720 NC(=O)CNCC(O)C1CC1 2230a_100000751198_100000747473 [0,2,0,0,0,0|1,0,1]=4 1799 B11R1.720 NC(=O)CNCC(O)C1CC1 34a_100000751198_100000187820 [0,2,0,0,0,0|1,0,1]=4 1800 B11R1.720 OC(CNCC(F)F)C1CC1 2230a_100000751198_100011934356 [0,2,0,0,0,0|2,0,0]=4 1801 B11R1.720 OC(CNCC(F)F)C1CC1 34a_100000751198_100011934356 [0,2,0,0,0,0|2,0,0]=4 1802 B11R1.96 CCCN(CC)CCC1CC1 2230a_100000226822_100000694398 [0,2,0,0,0,0|2,0,0]=4 1803 B11R1.96 CCCN(CC)CCC1CC1 269982a_100000226822_100000694398 [0,2,0,0,0,0|2,0,0]=4 1804 B11R1.96 CCN(CCO)CCC1CC1 2230a_100000210973_100000694398 [0,2,0,0,0,0|2,0,0]=4 1805 B11R1.96 CCN(CCO)CCC1CC1 269982a_100000210973_100000694398 [0,2,0,0,0,0|2,0,0]=4 1806 B11R1.285 C=CCCN(C)CCC1CC1 2230a_100020639649_100000694398 [0,2,0,0,0,0|2,0,0]=4 1807 B11R1.285 C=CCCN(C)CCC1CC1 269982a_100020639649_100000694398 [0,2,0,0,0,0|2,0,0]=4 1808 B11R1.285 CCCCN(C)CCC1CC1 2230a_100000207549_100000694398 [0,2,0,0,0,0|2,0,0]=4 1809 B11R1.285 CCCCN(C)CCC1CC1 269982a_100000207549_100000694398 [0,2,0,0,0,0|2,0,0]=4 1810 B11R1.285 CCCNC(=O)CCC1CC1 11a_100020643023_100000756386 [0,2,0,0,0,0|2,0,0]=4 1811 B11R1.285 CCCNC(=O)CCC1CC1 1626a_100020643023_100000756386 [0,2,0,0,0,0|2,0,0]=4 1812 B11R1.285 CCCNC(=O)CCC1CC1 240690a_100020643023_100000756386 [0,2,0,0,0,0|2,0,0]=4 1813 B11R1.285 CCCNC(=O)CCC1CC1 527a_100020643023_100000756386 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.285 CN(CCC#N)CCC1CC1 2230a_100000184479_100000694398 [0,2,0,0,0,0|1,0,1]=4 1815 B11R1.285 CN(CCCO)CCC1CC1 2230a_100000213112_100000694398 [0,2,0,0,0,0|2,0,0]=4 1816 B11R1.285 CN(CCCO)CCC1CC1 269982a_100000213112_100000694398 [0,2,0,0,0,0|2,0,0]=4 1817 B11R1.285 COCCN(C)CCC1CC1 2230a_100000743101_100000694398 [0,2,0,0,0,0|2,0,0]=4 1818 B11R1.285 COCCN(C)CCC1CC1 269982a_100000743101_100000694398 [0,2,0,0,0,0|2,0,0]=4 1819 B11R1.285 CSCCN(C)CCC1CC1 2230a_100000686725_100000694398 [0,2,0,0,0,0|2,0,0]=4 1820 B11R1.285 CSCCN(C)CCC1CC1 269982a_100000686725_100000694398 [0,2,0,0,0,0|2,0,0]=4 1821 B11R1.285 O=C(CCC1CC1)NCCF 11a_100000724931_100000756386 [0,2,0,0,0,0|2,0,0]=4 1822 B11R1.285 O=C(CCC1CC1)NCCF 1626a_100000724931_100000756386 [0,2,0,0,0,0|2,0,0]=4 1823 B11R1.285 O=C(CCC1CC1)NCCF 240690a_100000724931_100000756386 [0,2,0,0,0,0|2,0,0]=4 1824 B11R1.285 O=C(CCC1CC1)NCCF 527a_100000724931_100000756386 [0,2,0,0,0,0|2,0,0]=4 1825 B11R1.285 O=C(CCC1CC1)NCCO 240690a_100000210304_100000756386 [0,2,0,0,0,0|2,0,0]=4 1826 B11R1.285 O=C(CCC1CC1)NCCO 527a_100000210304_100000756386 [0,2,0,0,0,0|2,0,0]=4 1827 B11R1.294 CC(CO)N(C)CCC1CC1 2230a_100000693034_100000694398 [0,2,0,0,0,0|2,0,0]=4 1828 B11R1.294 CC(CO)N(C)CCC1CC1 269982a_100000693034_100000694398 [0,2,0,0,0,0|2,0,0]=4 1829 B11R1.294 CCC(C)N(C)CCC1CC1 2230a_100000741768_100000694398 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.294 CCC(C)N(C)CCC1CC1 269982a_100000741768_100000694398 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.351 CC(CC1CC1)N(C)CCO 270004a_100000210263_200000686933 [0,2,0,0,0,0|2,0,0]=4 1832 B11R1.351 CCCN(C)C(C)CC1CC1 270004a_100000747261_200000686933 [0,2,0,0,0,0|2,0,0]=4 1833 B11R1.140 CC(C)(CO)NCCC1CC1 2230a_100000210608_100000694398 [0,2,0,0,0,0|2,0,0]=4 1834 B11R1.140 CCC(C)(C)NCCC1CC1 2230a_100000211385_100000694398 [0,2,0,0,0,0|2,0,0]=4 1835 B11R1.171 C=C[C@@H](CO)NCCC1CC1 2230a_100016989147_100000694398 [0,2,0,0,0,0|2,0,0]=4 1836 B11R1.171 C=C[C@@H](CO)NCCC1CC1 34a_100016989147_100000694398 [0,2,0,0,0,0|2,0,0]=4 1837 B11R1.171 CCC(CC)NCCC1CC1 2230a_100000199018_100000694398 [0,2,0,0,0,0|2,0,0]=4 1838 B11R1.171 CCC(CC)NCCC1CC1 270004a_100000764129_100000210860 [0,2,0,0,0,0|2,0,0]=4 1839 B11R1.171 CC[C@@H](CO)NCCC1CC1 2230a_100000709445_100000694398 [0,2,0,0,0,0|2,0,0]=4 1840 B11R1.171 NCC(CN)OCCC1CC1 34a_100000031598_100000694398 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.171 OCC(CO)NCCC1CC1 2230a_100000759517_100000694398 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.198 CC(CC1CC1)N[C@H](C)CF 270004a_100102880703_200000686933 [0,2,0,0,0,0|2,0,0]=4 1843 B11R1.198 CC(CC1CC1)N[C@H](C)CO 270004a_100000737577_200000686933 [0,2,0,0,0,0|2,0,0]=4 1844 B11R1.198 CCC(C)NC(C)CC1CC1 270004a_100000209981_200000686933 [0,2,0,0,0,0|2,0,0]=4 1845 B11R1.290 CC(CCN)COCC1CC1 34a_106354213184_100000742324 [0,2,0,0,0,0|2,0,0]=4 1846 B11R1.290 CC(CCO)NCCC1CC1 34a_100000764129_100009893172 [0,2,0,0,0,0|2,0,0]=4 1847 B11R1.290 CCCC(=O)NCCC1CC1 1626a_100000764129_100000211992 [0,2,0,0,0,0|2,0,0]=4 1848 B11R1.290 CCCC(=O)NCCC1CC1 240690a_100000764129_100000211992 [0,2,0,0,0,0|2,0,0]=4 1849 B11R1.290 CCCC(=O)NCCC1CC1 527a_100000764129_100000211992 [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.290 CCCC(C)NCCC1CC1 2230a_100000741246_100000694398 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.290 CCCC(C)NCCC1CC1 270004a_100000764129_100000211909 [0,2,0,0,0,0|2,0,0]=4 1852 B11R1.290 CCCC(C)NCCC1CC1 34a_100000764129_100000766640 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.290 COCC(C)NCCC1CC1 270004a_100000764129_100000749346 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.290 COCC(C)NCCC1CC1 34a_100000764129_100000765312 [0,2,0,0,0,0|2,0,0]=4 1855 B11R1.290 COC[C@@H](C)NCCC1CC1 2230a_100000764878_100000694398 [0,2,0,0,0,0|2,0,0]=4 1856 B11R1.290 CSCC(C)NCCC1CC1 270004a_100000764129_100011216314 [0,2,0,0,0,0|2,0,0]=4 1857 B11R1.290 C[C@@H](CC#N)NCCC1CC1 2230a_100016994482_100000694398 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.290 C[C@H](CCO)NCCC1CC1 2230a_100000706166_100000694398 [0,2,0,0,0,0|2,0,0]=4 1859 B11R1.290 C[C@H](CCO)NCCC1CC1 34a_100000706166_100000694398 [0,2,0,0,0,0|2,0,0]=4 1860 B11R1.290 O=C(CCO)NCCC1CC1 240690a_100000764129_100011216618 [0,2,0,0,0,0|2,0,0]=4 1861 B11R1.524 CC(CO)NCC(O)C1CC1 2230a_100000751198_100012180447 [0,2,0,0,0,0|2,0,0]=4 1862 B11R1.524 CC(CO)NCC(O)C1CC1 34a_100000751198_100012180447 [0,2,0,0,0,0|2,0,0]=4 1863 B11R1.524 CCC(C)NCC(O)C1CC1 2230a_100000751198_100000758301 [0,2,0,0,0,0|2,0,0]=4 1864 B11R1.524 CCC(C)NCC(O)C1CC1 34a_100000751198_100011215416 [0,2,0,0,0,0|2,0,0]=4 1865 B11R1.99 C#CCCCNCCC1CC1 34a_100000718082_100000694398 [0,2,0,0,0,0|2,0,0]=4 1866 B11R1.99 C#CCCCNCCC1CC1 34a_100000764129_100000695029 [0,2,0,0,0,0|2,0,0]=4 1867 B11R1.99 C=CCCCNCCC1CC1 2230a_100000700776_100000694398 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.99 C=CCCCNCCC1CC1 34a_100000700776_100000694398 [0,2,0,0,0,0|2,0,0]=4 1869 B11R1.99 C=CCCCNCCC1CC1 34a_100000764129_100000757094 [0,2,0,0,0,0|2,0,0]=4 1870 B11R1.99 C=COCCNCCC1CC1 34a_100000764129_100000039644 [0,2,0,0,0,0|2,0,0]=4 1871 B11R1.99 CC/C=C\CNCCC1CC1 34a_100000764129_100103147603 [0,2,0,0,0,0|2,0,0]=4 1872 B11R1.99 CCC#CCNCCC1CC1 34a_100000764129_100009813939 [0,2,0,0,0,0|2,0,0]=4 1873 B11R1.99 CCCCCNCCC1CC1 2230a_100000209983_100000694398 [0,2,0,0,0,0|2,0,0]=4 1874 B11R1.99 CCCCCNCCC1CC1 34a_100000764129_100000718602 [0,2,0,0,0,0|2,0,0]=4 1875 B11R1.99 CCOCCNCCC1CC1 2230a_102516460346_100000694398 [0,2,0,0,0,0|2,0,0]=4 1876 B11R1.99 CCOCCNCCC1CC1 34a_100000764129_100000210147 [0,2,0,0,0,0|2,0,0]=4 1877 B11R1.99 CCOCCNCCC1CC1 34a_102516460346_100000694398 [0,2,0,0,0,0|2,0,0]=4 1878 B11R1.99 CCSCCNCCC1CC1 2230a_100000106463_100000694398 [0,2,0,0,0,0|2,0,0]=4 1879 B11R1.99 CCSCCNCCC1CC1 34a_100000764129_100000757381 [0,2,0,0,0,0|2,0,0]=4 1880 B11R1.99 CNCCCCCOC1CC1 34a_100000722520_100000211595 [0,2,0,0,0,0|2,0,0]=4 1881 B11R1.99 CNCCCOCCC1CC1 34a_100000213112_100000694398 [0,2,0,0,0,0|2,0,0]=4 1882 B11R1.99 CNCCOCCOC1CC1 34a_100000228057_100000211595 [0,2,0,0,0,0|2,0,0]=4 1883 B11R1.99 COCCCNCCC1CC1 34a_100000764129_100000740836 [0,2,0,0,0,0|2,0,0]=4 1884 B11R1.99 COCCCNCCC1CC1 34a_100150723488_100000694398 [0,2,0,0,0,0|2,0,0]=4 1885 B11R1.99 CSCCCNCCC1CC1 2230a_100000749238_100000694398 [0,2,0,0,0,0|2,0,0]=4 1886 B11R1.99 FCCCCNCCC1CC1 34a_100000764129_100000729493 [0,2,0,0,0,0|2,0,0]=4 1887 B11R1.99 NCCCCCCOC1CC1 34a_100000686447_100000211595 [0,2,0,0,0,0|2,0,0]=4 1888 B11R1.99 NCCCCCOCC1CC1 34a_100000762737_100000742324 [0,2,0,0,0,0|2,0,0]=4 1889 B11R1.99 NCCCCOCCC1CC1 34a_100000750430_100000694398 [0,2,0,0,0,0|2,0,0]=4 1890 B11R1.99 NCCOCCOCC1CC1 34a_100000211614_100000742324 [0,2,0,0,0,0|2,0,0]=4 1891 B11R1.99 OCC#CCNCCC1CC1 34a_100000764129_200000047223 [0,2,0,0,0,0|2,0,0]=4 1892 B11R1.99 OCCCCNCCC1CC1 2230a_100000750430_100000694398 [0,2,0,0,0,0|2,0,0]=4 1893 B11R1.99 OCCCCNCCC1CC1 34a_100000750430_100000694398 [0,2,0,0,0,0|2,0,0]=4 1894 B11R1.99 OCCCCNCCC1CC1 34a_100000764129_100011216708 [0,2,0,0,0,0|2,0,0]=4 1895 B11R1.176 C=C(C)CCNCCC1CC1 34a_100000764129_100000730704 [0,2,0,0,0,0|2,0,0]=4 1896 B11R1.176 CC(C)CCNCCC1CC1 269862a_100000764129_100000185833 [0,2,0,0,0,0|2,0,0]=4 1897 B11R1.176 CC(C)CCNCCC1CC1 34a_100000764129_100000210312 [0,2,0,0,0,0|2,0,0]=4 1898 B11R1.176 CC(C)CNCCOC1CC1 34a_100015185251_100000211595 [0,2,0,0,0,0|2,0,0]=4 1899 B11R1.176 CC(C)OCNCCC1CC1 34a_100000764129_100000709892 [0,2,0,0,0,0|2,0,0]=4 1900 B11R1.176 CC(O)CCNCCC1CC1 2230a_200000755665_100000694398 [0,2,0,0,0,0|2,0,0]=4 1901 B11R1.176 CC(O)CCNCCC1CC1 34a_100000764129_100012276601 [0,2,0,0,0,0|2,0,0]=4 1902 B11R1.176 CN(C)CCOCCC1CC1 7a_100000754188_100000755713 [0,2,0,0,0,0|2,0,0]=4 1903 B11R1.176 CN(C)CCSCCC1CC1 62a_100000764125_100000755713 [0,2,0,0,0,0|2,0,0]=4 1904 B11R1.176 C[C@@H](N)CCOCCC1CC1 34a_100000706166_100000694398 [0,2,0,0,0,0|2,0,0]=4 1905 B11R1.176 NC(=O)CCNCCC1CC1 34a_100000764129_100000731001 [0,2,0,0,0,0|1,0,0]=3 1906 B11R1.176 NC(=O)CCOCCC1CC1 34a_100000754188_100000731001 [0,2,0,0,0,0|2,0,0]=4 1907 B11R1.176 NC(=O)CCOCCC1CC1 34a_100000757172_100000694398 [0,2,0,0,0,0|2,0,0]=4 1908 B11R1.176 NC(=O)CCOCCC1CC1 7a_100000754188_100000744528 [0,2,0,0,0,0|2,0,0]=4 1909 B11R1.176 NC(=O)CCOCCC1CC1 7a_100000757172_100000764125 [0,2,0,0,0,0|2,0,0]=4 1910 B11R1.176 NC(=O)CCSCCC1CC1 62a_100000744528_100000764125 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.176 NC(=O)CCSCCC1CC1 62a_100000764125_100000744528 [0,2,0,0,0,0|2,0,0]=4 1912 B11R1.301 C=CCCNC(C)CC1CC1 270004a_100015191253_200000686933 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.301 CC(CC1CC1)NCCC#N 270004a_100000720768_200000686933 [0,2,0,0,0,0|1,0,1]=4 1914 B11R1.301 CC(CC1CC1)NCCCF 270004a_100015189416_200000686933 [0,2,0,0,0,0|2,0,0]=4 1915 B11R1.301 CC(CC1CC1)NCCCO 270004a_100000182051_200000686933 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.301 CCCCNC(C)CC1CC1 270004a_100000102301_200000686933 [0,2,0,0,0,0|2,0,0]=4 1917 B11R1.301 COCCNC(C)CC1CC1 270004a_100000209980_200000686933 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.301 CSCCNC(C)CC1CC1 270004a_100020590264_200000686933 [0,2,0,0,0,0|2,0,0]=4 1919 B11R1.356 C#CCCNCC(O)C1CC1 2230a_100000751198_100000688953 [0,2,0,0,0,0|2,0,0]=4 1920 B11R1.356 C#CCCNCC(O)C1CC1 34a_100000751198_100000688953 [0,2,0,0,0,0|2,0,0]=4 1921 B11R1.356 C=CCCNCC(O)C1CC1 2230a_100000751198_100000754431 [0,2,0,0,0,0|2,0,0]=4 1922 B11R1.356 C=CCCNCC(O)C1CC1 34a_100000751198_100000754431 [0,2,0,0,0,0|2,0,0]=4 1923 B11R1.356 CCCCNCC(O)C1CC1 2230a_100000751198_100000210211 [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.356 CCCCNCC(O)C1CC1 34a_100000751198_100000210210 [0,2,0,0,0,0|2,0,0]=4 1925 B11R1.356 COCCNCC(O)C1CC1 2230a_100000751198_100011201679 [0,2,0,0,0,0|2,0,0]=4 1926 B11R1.356 COCCNCC(O)C1CC1 34a_100000751198_100011201679 [0,2,0,0,0,0|2,0,0]=4 1927 B11R1.356 CSCCNCC(O)C1CC1 2230a_100000751198_100000751147 [0,2,0,0,0,0|2,0,0]=4 1928 B11R1.356 CSCCNCC(O)C1CC1 34a_100000751198_100000212216 [0,2,0,0,0,0|2,0,0]=4 1929 B11R1.356 N#CCCNCC(O)C1CC1 2230a_100000751198_100011215226 [0,2,0,0,0,0|1,0,1]=4 1930 B11R1.356 OC(CNCCCF)C1CC1 2230a_100000751198_100011934791 [0,2,0,0,0,0|2,0,0]=4 1931 B11R1.356 OC(CNCCCF)C1CC1 34a_100000751198_100011934791 [0,2,0,0,0,0|2,0,0]=4 1932 B11R1.356 OCCCNCC(O)C1CC1 2230a_100000751198_100000230001 [0,2,0,0,0,0|2,0,0]=4 1933 B11R1.356 OCCCNCC(O)C1CC1 34a_100000751198_100000230001 [0,2,0,0,0,0|2,0,0]=4 1934 B9R1.8 CCCN1CCOCC1 2230a_100015191051_100000210303 [0,0,1,1,0,0|2,0,0]=4 1935 B9R1.8 CCCN1CCOCC1 269982a_100015191051_100000210303 [0,0,1,1,0,0|2,0,0]=4 1936 B9R1.8 CCCN1CCOCC1 34a_100015191051_100000210303 [0,0,1,1,0,0|2,0,0]=4 1937 B9R1.8 CCCN1CCSCC1 2230a_100000737611_100000210303 [0,0,1,1,0,0|2,0,0]=4 1938 B9R1.8 CCCN1CCSCC1 269982a_100000737611_100000210303 [0,0,1,1,0,0|2,0,0]=4 1939 B9R1.8 CCNC1CCCCC1 2230a_100000182618_100000210202 [0,0,1,1,0,0|2,0,0]=4 1940 B9R1.8 CCNC1CCCCC1 270004a_100015525214_100000210434 [0,0,1,1,0,0|2,0,0]=4 1941 B9R1.8 CCNC1CCCCC1 34a_100000182618_100000210202 [0,0,1,1,0,0|2,0,0]=4 1942 B9R1.8 CCNC1CCCOC1 2230a_100000719290_100000210202 [0,0,1,1,0,0|2,0,0]=4 1943 B9R1.8 CCNC1CCCOC1 270004a_100015525214_100000753404 [0,0,1,1,0,0|2,0,0]=4 1944 B9R1.8 CCNC1CCCOC1 34a_100000719290_100000210202 [0,0,1,1,0,0|2,0,0]=4 1945 B9R1.8 CCNC1CCCSC1 270004a_100015525214_100000057913 [0,0,1,1,0,0|2,0,0]=4 1946 B9R1.8 FCCN1CCOCC1 2230a_100015191051_100011217306 [0,0,1,1,0,0|2,0,0]=4 1947 B9R1.8 FCCN1CCOCC1 269982a_100015191051_100011217306 [0,0,1,1,0,0|2,0,0]=4 1948 B9R1.8 FCCN1CCOCC1 34a_100015191051_100011217306 [0,0,1,1,0,0|2,0,0]=4 1949 B9R1.8 FCCN1CCSCC1 2230a_100000737611_100011217306 [0,0,1,1,0,0|2,0,0]=4 1950 B9R1.8 FCCN1CCSCC1 269982a_100000737611_100011217306 [0,0,1,1,0,0|2,0,0]=4 1951 B9R1.8 OCCN1CCOCC1 2230a_100015191051_100000211926 [0,0,1,1,0,0|2,0,0]=4 1952 B9R1.8 OCCN1CCOCC1 269982a_100015191051_100000211926 [0,0,1,1,0,0|2,0,0]=4 1953 B9R1.8 OCCN1CCOCC1 34a_100015191051_100000211926 [0,0,1,1,0,0|2,0,0]=4 1954 B9R1.8 OCCN1CCSCC1 2230a_100000737611_100000211926 [0,0,1,1,0,0|2,0,0]=4 1955 B9R1.8 OCCN1CCSCC1 269982a_100000737611_100000211926 [0,0,1,1,0,0|2,0,0]=4 1956 B9R1.12 CCCNC1CCCC1 2230a_100000211070_100000210303 [0,0,1,1,0,0|2,0,0]=4 1957 B9R1.12 CCCNC1CCCC1 270004a_100020643023_100000210133 [0,0,1,1,0,0|2,0,0]=4 1958 B9R1.12 CCCNC1CCCC1 34a_100000211070_100000210303 [0,0,1,1,0,0|2,0,0]=4 1959 B9R1.12 CCCNC1CCOC1 270004a_100020643023_100000752484 [0,0,1,1,0,0|2,0,0]=4 1960 B9R1.12 CCCNC1CCSC1 270004a_100020643023_100000212027 [0,0,1,1,0,0|2,0,0]=4 1961 B9R1.12 CCCN[C@@H]1CCOC1 2230a_200015188469_100000210303 [0,0,1,1,0,0|2,0,0]=4 1962 B9R1.12 CCCN[C@H]1CCOC1 2230a_100015188467_100000210303 [0,0,1,1,0,0|2,0,0]=4 1963 B9R1.12 CCCN[C@H]1CCOC1 34a_100015188467_100000210303 [0,0,1,1,0,0|2,0,0]=4 1964 B9R1.12 CCNCC1CCCC1 2230a_100000737975_100000210202 [0,0,1,1,0,0|2,0,0]=4 1965 B9R1.12 CCNCC1CCCC1 2230a_100015525214_100000740388 [0,0,1,1,0,0|2,0,0]=4 1966 B9R1.12 CCNCC1CCCC1 269862a_100015525214_100000746403 [0,0,1,1,0,0|2,0,0]=4 1967 B9R1.12 CCNCC1CCCC1 34a_100000737975_100000210202 [0,0,1,1,0,0|2,0,0]=4 1968 B9R1.12 CCNCC1CCCO1 2230a_100015525214_100000203698 [0,0,1,1,0,0|2,0,0]=4 1969 B9R1.12 CCNCC1OCCO1 2230a_100000036311_100000210202 [0,0,1,1,0,0|2,0,0]=4 1970 B9R1.12 CCNCC1OCCO1 2230a_100015525214_100000755774 [0,0,1,1,0,0|2,0,0]=4 1971 B9R1.12 CCNCC1OCCO1 34a_100000036311_100000210202 [0,0,1,1,0,0|2,0,0]=4 1972 B9R1.12 CCNC[C@@H]1CCCO1 2230a_100020590478_100000210202 [0,0,1,1,0,0|2,0,0]=4 1973 B9R1.12 CCNC[C@@H]1CCCO1 34a_100020590478_100000210202 [0,0,1,1,0,0|2,0,0]=4 1974 B9R1.12 CCOC[C@H]1CCCN1 34a_100000745186_100000210202 [0,0,1,1,0,0|2,0,0]=4 1975 B9R1.12 FCCNC1CCCC1 2230a_100000211070_100011217306 [0,0,1,1,0,0|2,0,0]=4 1976 B9R1.12 FCCNC1CCCC1 34a_100000211070_100011217306 [0,0,1,1,0,0|2,0,0]=4 1977 B9R1.12 FCCNC1CCCC1 34a_100000724931_100000179811 [0,0,1,1,0,0|2,0,0]=4 1978 B9R1.12 FCCNC1CCOC1 34a_100000724931_100000690089 [0,0,1,1,0,0|2,0,0]=4 1979 B9R1.12 FCCN[C@@H]1CCOC1 2230a_200015188469_100011217306 [0,0,1,1,0,0|2,0,0]=4 1980 B9R1.12 FCCN[C@H]1CCOC1 2230a_100015188467_100011217306 [0,0,1,1,0,0|2,0,0]=4 1981 B9R1.12 FCCN[C@H]1CCOC1 34a_100015188467_100011217306 [0,0,1,1,0,0|2,0,0]=4 1982 B9R1.12 NCCOC1CCCC1 34a_100000210304_100000179811 [0,0,1,1,0,0|2,0,0]=4 1983 B9R1.12 NCCOC1CCOC1 34a_100000210304_100000690089 [0,0,1,1,0,0|2,0,0]=4 1984 B9R1.12 OCCNC1CCCC1 2230a_100000211070_100000211926 [0,0,1,1,0,0|2,0,0]=4 1985 B9R1.12 OCCNC1CCCC1 2230a_100016997473_100000179811 [0,0,1,1,0,0|2,0,0]=4 1986 B9R1.12 OCCNC1CCCC1 270004a_100000210304_100000210133 [0,0,1,1,0,0|2,0,0]=4 1987 B9R1.12 OCCNC1CCCC1 34a_100000211070_100000211926 [0,0,1,1,0,0|2,0,0]=4 1988 B9R1.12 OCCNC1CCCC1 34a_100016990907_100000179811 [0,0,1,1,0,0|2,0,0]=4 1989 B9R1.12 OCCNC1CCOC1 2230a_100016997473_100000731011 [0,0,1,1,0,0|2,0,0]=4 1990 B9R1.12 OCCNC1CCOC1 270004a_100000210304_100000752484 [0,0,1,1,0,0|2,0,0]=4 1991 B9R1.12 OCCNC1CCOC1 34a_100016990907_100000690089 [0,0,1,1,0,0|2,0,0]=4 1992 B9R1.12 OCCNC1CCSC1 270004a_100000210304_100000212027 [0,0,1,1,0,0|2,0,0]=4 1993 B9R1.12 OCCN[C@@H]1CCOC1 2230a_200015188469_100000211926 [0,0,1,1,0,0|2,0,0]=4 1994 B9R1.12 OCCN[C@H]1CCOC1 2230a_100015188467_100000211926 [0,0,1,1,0,0|2,0,0]=4 1995 B9R1.12 OCCN[C@H]1CCOC1 34a_100015188467_100000211926 [0,0,1,1,0,0|2,0,0]=4 1996 B9R1.14 CCC1CCCN1CC 2230a_100000754278_100000210202 [0,0,1,1,0,0|2,0,0]=4 1997 B9R1.14 CCC1CCCN1CC 269982a_100000754278_100000204670 [0,0,1,1,0,0|2,0,0]=4 1998 B9R1.14 CCC1CCCN1CC 34a_100000754278_100000210202 [0,0,1,1,0,0|2,0,0]=4 1999 B9R1.14 CCN1CCC[C@@H]1CO 2230a_100000745186_100000210202 [0,0,1,1,0,0|2,0,0]=4 2000 B9R1.14 CCN1CCC[C@@H]1CO 269982a_100000745186_100000204670 [0,0,1,1,0,0|2,0,0]=4 2001 B9R1.14 CCN1CCC[C@@H]1CO 34a_100000745186_100000210202 [0,0,1,1,0,0|2,0,0]=4 2002 B9R1.15 CCN1CCCCC1C 2230a_100000211376_100000210202 [0,0,1,1,0,0|2,0,0]=4 2003 B9R1.15 CCN1CCCCC1C 269982a_100000211376_100000204670 [0,0,1,1,0,0|2,0,0]=4 2004 B9R1.15 CCN1CCCCC1C 34a_100000211376_100000210202 [0,0,1,1,0,0|2,0,0]=4 2005 B9R1.15 CCN1CCOC[C@@H]1C 2230a_100009815349_100000210202 [0,0,1,1,0,0|2,0,0]=4 2006 B9R1.15 CCN1CCOC[C@@H]1C 269982a_100009815349_100000204670 [0,0,1,1,0,0|2,0,0]=4 2007 B9R1.15 CCN1CCOC[C@@H]1C 34a_100009815349_100000210202 [0,0,1,1,0,0|2,0,0]=4 2008 B9R1.17 CCCCCN1CCC1 269982a_100000754969_100000210215 [0,0,1,1,0,0|2,0,0]=4 2009 B9R1.17 CCCNCC1CCC1 2230a_100000738700_100000210303 [0,0,1,1,0,0|2,0,0]=4 2010 B9R1.17 CCCNCC1CCC1 269862a_100020643023_100000753134 [0,0,1,1,0,0|2,0,0]=4 2011 B9R1.17 CCCNCC1CCC1 34a_100000738700_100000210303 [0,0,1,1,0,0|2,0,0]=4 2012 B9R1.17 CCCNC[C@@H]1CCO1 2230a_100020831831_100000210303 [0,0,1,1,0,0|2,0,0]=4 2013 B9R1.17 CCCNC[C@@H]1CCO1 34a_100020831831_100000210303 [0,0,1,1,0,0|2,0,0]=4 2014 B9R1.17 CCOCCN1CCC1 269982a_100000754969_100011215890 [0,0,1,1,0,0|2,0,0]=4 2015 B9R1.17 CCSCCN1CCC1 269982a_100000754969_100000757381 [0,0,1,1,0,0|2,0,0]=4 2016 B9R1.17 FCCNCC1CCC1 2230a_100000738700_100011217306 [0,0,1,1,0,0|2,0,0]=4 2017 B9R1.17 FCCNCC1CCC1 269862a_100000724931_100000753134 [0,0,1,1,0,0|2,0,0]=4 2018 B9R1.17 FCCNCC1CCC1 34a_100000724931_100000763275 [0,0,1,1,0,0|2,0,0]=4 2019 B9R1.17 FCCNCC1CCC1 34a_100000738700_100011217306 [0,0,1,1,0,0|2,0,0]=4 2020 B9R1.17 FCCNCC1CCO1 34a_100000724931_100000103362 [0,0,1,1,0,0|2,0,0]=4 2021 B9R1.17 FCCNC[C@@H]1CCO1 2230a_100020831831_100011217306 [0,0,1,1,0,0|2,0,0]=4 2022 B9R1.17 FCCNC[C@@H]1CCO1 34a_100020831831_100011217306 [0,0,1,1,0,0|2,0,0]=4 2023 B9R1.17 NCCOCC1CCC1 34a_100000210304_100000763275 [0,0,1,1,0,0|2,0,0]=4 2024 B9R1.17 NCCOCC1CCO1 34a_100000210304_100000103362 [0,0,1,1,0,0|2,0,0]=4 2025 B9R1.17 OCCNCC1CCC1 2230a_100000738700_100000211926 [0,0,1,1,0,0|2,0,0]=4 2026 B9R1.17 OCCNCC1CCC1 2230a_100016997473_100000763275 [0,0,1,1,0,0|2,0,0]=4 2027 B9R1.17 OCCNCC1CCC1 269862a_100000210304_100000753134 [0,0,1,1,0,0|2,0,0]=4 2028 B9R1.17 OCCNCC1CCC1 34a_100000738700_100000211926 [0,0,1,1,0,0|2,0,0]=4 2029 B9R1.17 OCCNCC1CCC1 34a_100016990907_100000763275 [0,0,1,1,0,0|2,0,0]=4 2030 B9R1.17 OCCNCC1CCO1 2230a_100016997473_100000103362 [0,0,1,1,0,0|2,0,0]=4 2031 B9R1.17 OCCNCC1CCO1 34a_100016990907_100000103362 [0,0,1,1,0,0|2,0,0]=4 2032 B9R1.17 OCCNC[C@@H]1CCO1 2230a_100020831831_100000211926 [0,0,1,1,0,0|2,0,0]=4 2033 B9R1.17 OCCNC[C@@H]1CCO1 34a_100020831831_100000211926 [0,0,1,1,0,0|2,0,0]=4 2034 B9R1.33 CC1SCCN1CCF 2230a_200011216479_100011217306 [0,0,1,1,0,0|2,0,0]=4 2035 B9R1.33 CC1SCCN1CCF 269982a_200011216479_100011217306 [0,0,1,1,0,0|2,0,0]=4 2036 B9R1.33 CC1SCCN1CCF 34a_200011216479_100011217306 [0,0,1,1,0,0|2,0,0]=4 2037 B9R1.33 CC1SCCN1CCO 2230a_200011216479_100000211926 [0,0,1,1,0,0|2,0,0]=4 2038 B9R1.33 CC1SCCN1CCO 269982a_200011216479_100000211926 [0,0,1,1,0,0|2,0,0]=4 2039 B9R1.33 CC1SCCN1CCO 34a_200011216479_100000211926 [0,0,1,1,0,0|2,0,0]=4 2040 B9R1.33 CCCN1CCC[C@@H]1C 2230a_100020605311_100000210303 [0,0,1,1,0,0|2,0,0]=4 2041 B9R1.33 CCCN1CCC[C@@H]1C 269982a_100020605311_100000210303 [0,0,1,1,0,0|2,0,0]=4 2042 B9R1.33 CCCN1CCC[C@H]1C 2230a_100015189458_100000210303 [0,0,1,1,0,0|2,0,0]=4 2043 B9R1.33 CCCN1CCC[C@H]1C 269982a_100015189458_100000210303 [0,0,1,1,0,0|2,0,0]=4 2044 B9R1.33 CCCN1CCC[C@H]1C 34a_100015189458_100000210303 [0,0,1,1,0,0|2,0,0]=4 2045 B9R1.33 CCCN1CCSC1C 2230a_200011216479_100000210303 [0,0,1,1,0,0|2,0,0]=4 2046 B9R1.33 CCCN1CCSC1C 269982a_200011216479_100000210303 [0,0,1,1,0,0|2,0,0]=4 2047 B9R1.33 CCCN1CCSC1C 34a_200011216479_100000210303 [0,0,1,1,0,0|2,0,0]=4 2048 B9R1.33 CCNC1CCCC1C 269862a_100015525214_100000752053 [0,0,1,1,0,0|2,0,0]=4 2049 B9R1.33 CCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210202 [0,0,1,1,0,0|2,0,0]=4 2050 B9R1.33 CCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210202 [0,0,1,1,0,0|2,0,0]=4 2051 B9R1.33 CCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210202 [0,0,1,1,0,0|2,0,0]=4 2052 B9R1.33 CCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210202 [0,0,1,1,0,0|2,0,0]=4 2053 B9R1.33 C[C@@H]1CCCN1CCF 2230a_100015189458_100011217306 [0,0,1,1,0,0|2,0,0]=4 2054 B9R1.33 C[C@@H]1CCCN1CCF 269982a_100015189458_100011217306 [0,0,1,1,0,0|2,0,0]=4 2055 B9R1.33 C[C@@H]1CCCN1CCF 34a_100015189458_100011217306 [0,0,1,1,0,0|2,0,0]=4 2056 B9R1.33 C[C@@H]1CCCN1CCO 2230a_100015189458_100000211926 [0,0,1,1,0,0|2,0,0]=4 2057 B9R1.33 C[C@@H]1CCCN1CCO 269982a_100015189458_100000211926 [0,0,1,1,0,0|2,0,0]=4 2058 B9R1.33 C[C@@H]1CCCN1CCO 34a_100015189458_100000211926 [0,0,1,1,0,0|2,0,0]=4 2059 B9R1.33 C[C@H]1CCCN1CCF 2230a_100020605311_100011217306 [0,0,1,1,0,0|2,0,0]=4 2060 B9R1.33 C[C@H]1CCCN1CCF 269982a_100020605311_100011217306 [0,0,1,1,0,0|2,0,0]=4 2061 B9R1.33 C[C@H]1CCCN1CCO 2230a_100020605311_100000211926 [0,0,1,1,0,0|2,0,0]=4 2062 B9R1.33 C[C@H]1CCCN1CCO 269982a_100020605311_100000211926 [0,0,1,1,0,0|2,0,0]=4 2063 B9R1.89 CCN1CCCCCC1 2230a_100000185865_100000210202 [0,0,1,1,0,0|2,0,0]=4 2064 B9R1.89 CCN1CCCCCC1 269982a_100000185865_100000204670 [0,0,1,1,0,0|2,0,0]=4 2065 B9R1.89 CCN1CCCCCC1 34a_100000185865_100000210202 [0,0,1,1,0,0|2,0,0]=4 2066 B9R1.89 CCN1CCCOCC1 2230a_100000685342_100000210202 [0,0,1,1,0,0|2,0,0]=4 2067 B9R1.89 CCN1CCCOCC1 269982a_100000685342_100000204670 [0,0,1,1,0,0|2,0,0]=4 2068 B9R1.89 CCN1CCCOCC1 34a_100000685342_100000210202 [0,0,1,1,0,0|2,0,0]=4 2069 B9R1.2 CCC1CN(CCO1)C 2230a_100000736320_200000210301 [0,0,1,1,0,0|2,0,0]=4 2070 B9R1.2 CCC1CN(CCO1)C 269982a_100000736320_200000210301 [0,0,1,1,0,0|2,0,0]=4 2071 B9R1.2 CCC1CN(CCO1)C 34a_100000736320_200000210301 [0,0,1,1,0,0|2,0,0]=4 2072 B9R1.2 CCC1CN(CCO1)[13CH3] 2230a_100000736320_200025704644 [0,0,1,1,0,0|2,0,0]=4 2073 B9R1.2 CCC1CN(CCO1)[13CH3] 269982a_100000736320_200025704644 [0,0,1,1,0,0|2,0,0]=4 2074 B9R1.2 CCC1CN(CCO1)[13CH3] 34a_100000736320_200025704644 [0,0,1,1,0,0|2,0,0]=4 2075 B9R1.2 CN1CCCC(C1)CF 2230a_100016992999_200000210301 [0,0,1,1,0,0|2,0,0]=4 2076 B9R1.2 CN1CCCC(C1)CF 269982a_100016992999_200000210301 [0,0,1,1,0,0|2,0,0]=4 2077 B9R1.2 CN1CCCC(C1)CF 34a_100016992999_200000210301 [0,0,1,1,0,0|2,0,0]=4 2078 B9R1.2 CN1CCCC(C1)CO 2230a_100000211344_200000210301 [0,0,1,1,0,0|2,0,0]=4 2079 B9R1.2 CN1CCCC(C1)CO 269982a_100000211344_200000210301 [0,0,1,1,0,0|2,0,0]=4 2080 B9R1.2 CN1CCCC(C1)CO 34a_100000211344_200000210301 [0,0,1,1,0,0|2,0,0]=4 2081 B9R1.2 CN1CCO[C@@H](C1)CO 2230a_100015189573_200000210301 [0,0,1,1,0,0|2,0,0]=4 2082 B9R1.2 CN1CCO[C@@H](C1)CO 269982a_100015189573_200000210301 [0,0,1,1,0,0|2,0,0]=4 2083 B9R1.2 CN1CCO[C@@H](C1)CO 34a_100015189573_200000210301 [0,0,1,1,0,0|2,0,0]=4 2084 B9R1.2 [13CH3]N1CCCC(C1)CF 2230a_100016992999_200025704644 [0,0,1,1,0,0|2,0,0]=4 2085 B9R1.2 [13CH3]N1CCCC(C1)CF 269982a_100016992999_200025704644 [0,0,1,1,0,0|2,0,0]=4 2086 B9R1.2 [13CH3]N1CCCC(C1)CF 34a_100016992999_200025704644 [0,0,1,1,0,0|2,0,0]=4 2087 B9R1.2 [13CH3]N1CCCC(C1)CO 2230a_100000211344_200025704644 [0,0,1,1,0,0|2,0,0]=4 2088 B9R1.2 [13CH3]N1CCCC(C1)CO 269982a_100000211344_200025704644 [0,0,1,1,0,0|2,0,0]=4 2089 B9R1.2 [13CH3]N1CCCC(C1)CO 34a_100000211344_200025704644 [0,0,1,1,0,0|2,0,0]=4 2090 B9R1.2 [13CH3]N1CCO[C@@H](C1)CO 2230a_100015189573_200025704644 [0,0,1,1,0,0|2,0,0]=4 2091 B9R1.2 [13CH3]N1CCO[C@@H](C1)CO 269982a_100015189573_200025704644 [0,0,1,1,0,0|2,0,0]=4 2092 B9R1.2 [13CH3]N1CCO[C@@H](C1)CO 34a_100015189573_200025704644 [0,0,1,1,0,0|2,0,0]=4 2093 B9R1.6 CN(C)C1CCCCC1 2230a_100000207522_200000210301 [0,0,1,1,0,0|2,0,0]=4 2094 B9R1.6 CN(C)C1CCCCC1 269982a_100000207522_200000210301 [0,0,1,1,0,0|2,0,0]=4 2095 B9R1.6 CN(C)C1CCCCC1 269982a_100102631434_100000210327 [0,0,1,1,0,0|2,0,0]=4 2096 B9R1.6 CN(C)C1CCCCC1 270004a_100102631434_100000210434 [0,0,1,1,0,0|2,0,0]=4 2097 B9R1.6 CN(C)C1CCCCC1 34a_100000207522_200000210301 [0,0,1,1,0,0|2,0,0]=4 2098 B9R1.6 CN(C)C1CCCOC1 269982a_100102631434_100000693364 [0,0,1,1,0,0|2,0,0]=4 2099 B9R1.6 CN(C)C1CCCOC1 270004a_100102631434_100000753404 [0,0,1,1,0,0|2,0,0]=4 2100 B9R1.6 CN(C)C1CCCSC1 270004a_100102631434_100000057913 [0,0,1,1,0,0|2,0,0]=4 2101 B9R1.6 CN([13CH3])C1CCCCC1 2230a_100000207522_200025704644 [0,0,1,1,0,0|2,0,0]=4 2102 B9R1.6 CN([13CH3])C1CCCCC1 269982a_100000207522_200025704644 [0,0,1,1,0,0|2,0,0]=4 2103 B9R1.6 CN([13CH3])C1CCCCC1 34a_100000207522_200025704644 [0,0,1,1,0,0|2,0,0]=4 2104 B9R1.7 CCCN1CC[C@H](C1)C 2230a_100016987628_100000210303 [0,0,1,1,0,0|2,0,0]=4 2105 B9R1.7 CCCN1CC[C@H](C1)C 269982a_100016987628_100000210303 [0,0,1,1,0,0|2,0,0]=4 2106 B9R1.7 CCCN1CC[C@H](C1)C 34a_100016987628_100000210303 [0,0,1,1,0,0|2,0,0]=4 2107 B9R1.7 CN1CCC(C1)CCO 2230a_100016987287_200000210301 [0,0,1,1,0,0|2,0,0]=4 2108 B9R1.7 CN1CCC(C1)CCO 269982a_100016987287_200000210301 [0,0,1,1,0,0|2,0,0]=4 2109 B9R1.7 CN1CCC(C1)CCO 34a_100016987287_200000210301 [0,0,1,1,0,0|2,0,0]=4 2110 B9R1.7 C[C@@H]1CCN(C1)CCF 2230a_100016987628_100011217306 [0,0,1,1,0,0|2,0,0]=4 2111 B9R1.7 C[C@@H]1CCN(C1)CCF 269982a_100016987628_100011217306 [0,0,1,1,0,0|2,0,0]=4 2112 B9R1.7 C[C@@H]1CCN(C1)CCF 34a_100016987628_100011217306 [0,0,1,1,0,0|2,0,0]=4 2113 B9R1.7 C[C@@H]1CCN(C1)CCO 2230a_100016987628_100000211926 [0,0,1,1,0,0|2,0,0]=4 2114 B9R1.7 C[C@@H]1CCN(C1)CCO 269982a_100016987628_100000211926 [0,0,1,1,0,0|2,0,0]=4 2115 B9R1.7 C[C@@H]1CCN(C1)CCO 34a_100016987628_100000211926 [0,0,1,1,0,0|2,0,0]=4 2116 B9R1.7 [13CH3]N1CCC(C1)CCO 2230a_100016987287_200025704644 [0,0,1,1,0,0|2,0,0]=4 2117 B9R1.7 [13CH3]N1CCC(C1)CCO 269982a_100016987287_200025704644 [0,0,1,1,0,0|2,0,0]=4 2118 B9R1.7 [13CH3]N1CCC(C1)CCO 34a_100016987287_200025704644 [0,0,1,1,0,0|2,0,0]=4 2119 B9R1.9 CCCOC1CN(C1)C 269982a_200020626125_200000210301 [0,0,1,1,0,0|2,0,0]=4 2120 B9R1.9 CCCOC1CN(C1)C 34a_200020626125_200000210301 [0,0,1,1,0,0|2,0,0]=4 2121 B9R1.9 CCCOC1CN(C1)[13CH3] 269982a_200020626125_200025704644 [0,0,1,1,0,0|2,0,0]=4 2122 B9R1.9 CCCOC1CN(C1)[13CH3] 34a_200020626125_200025704644 [0,0,1,1,0,0|2,0,0]=4 2123 B9R1.13 CN(C)CC1=NCCN1 269982a_100102631434_100000737910 [0,0,1,1,0,0|0,0,2]=4 2124 B9R1.13 CN(C)CC1CCCC1 2230a_100102631434_100000740388 [0,0,1,1,0,0|2,0,0]=4 2125 B9R1.13 CN(C)CC1CCCC1 269982a_100102631434_100000740388 [0,0,1,1,0,0|2,0,0]=4 2126 B9R1.13 CN(C)CC1CCCO1 2230a_100102631434_100000203698 [0,0,1,1,0,0|2,0,0]=4 2127 B9R1.13 CN(C)CC1CCCO1 2230a_100102946541_200000210301 [0,0,1,1,0,0|2,0,0]=4 2128 B9R1.13 CN(C)CC1CCCO1 269982a_100102631434_100000183445 [0,0,1,1,0,0|2,0,0]=4 2129 B9R1.13 CN(C)CC1CCCO1 269982a_100102946541_200000210301 [0,0,1,1,0,0|2,0,0]=4 2130 B9R1.13 CN(C)CC1CCCO1 34a_100102946541_200000210301 [0,0,1,1,0,0|2,0,0]=4 2131 B9R1.13 CN(C)CC1OCCO1 2230a_100102631434_100000755774 [0,0,1,1,0,0|2,0,0]=4 2132 B9R1.13 CN(C)CC1OCCO1 2230a_200000032744_200000210301 [0,0,1,1,0,0|2,0,0]=4 2133 B9R1.13 CN(C)CC1OCCO1 269982a_100102631434_100000755774 [0,0,1,1,0,0|2,0,0]=4 2134 B9R1.13 CN(C)CC1OCCO1 269982a_200000032744_200000210301 [0,0,1,1,0,0|2,0,0]=4 2135 B9R1.13 CN(C)CC1OCCO1 34a_200000032744_200000210301 [0,0,1,1,0,0|2,0,0]=4 2136 B9R1.13 CN([13CH3])CC1CCCO1 2230a_100102946541_200025704644 [0,0,1,1,0,0|2,0,0]=4 2137 B9R1.13 CN([13CH3])CC1CCCO1 269982a_100102946541_200025704644 [0,0,1,1,0,0|2,0,0]=4 2138 B9R1.13 CN([13CH3])CC1CCCO1 34a_100102946541_200025704644 [0,0,1,1,0,0|2,0,0]=4 2139 B9R1.13 CN([13CH3])CC1OCCO1 2230a_200000032744_200025704644 [0,0,1,1,0,0|2,0,0]=4 2140 B9R1.13 CN([13CH3])CC1OCCO1 269982a_200000032744_200025704644 [0,0,1,1,0,0|2,0,0]=4 2141 B9R1.13 CN([13CH3])CC1OCCO1 34a_200000032744_200025704644 [0,0,1,1,0,0|2,0,0]=4 2142 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O 269982a_100102631434_200016002552 [0,0,1,1,0,0|2,0,0]=4 2143 B9R1.48 CN1CCCCC(C1)O 2230a_100025706797_200000210301 [0,0,1,1,0,0|2,0,0]=4 2144 B9R1.48 CN1CCCCC(C1)O 269982a_100025706797_200000210301 [0,0,1,1,0,0|2,0,0]=4 2145 B9R1.48 CN1CCOC[C@@H](C1)O 2230a_100016073750_200000210301 [0,0,1,1,0,0|2,0,0]=4 2146 B9R1.48 CN1CCOC[C@@H](C1)O 269982a_100016073750_200000210301 [0,0,1,1,0,0|2,0,0]=4 2147 B9R1.48 [13CH3]N1CCCCC(C1)O 2230a_100025706797_200025704644 [0,0,1,1,0,0|2,0,0]=4 2148 B9R1.48 [13CH3]N1CCCCC(C1)O 269982a_100025706797_200025704644 [0,0,1,1,0,0|2,0,0]=4 2149 B9R1.48 [13CH3]N1CCOC[C@@H](C1)O 2230a_100016073750_200025704644 [0,0,1,1,0,0|2,0,0]=4 2150 B9R1.48 [13CH3]N1CCOC[C@@H](C1)O 269982a_100016073750_200025704644 [0,0,1,1,0,0|2,0,0]=4 2151 B9R1.84 CC(C)CCN1CCC1 269982a_100000754969_100000210312 [0,0,1,1,0,0|2,0,0]=4 2152 B9R1.84 CN(C)CCN1CCC1 269982a_100000754969_100000755713 [0,0,1,1,0,0|1,0,0]=3 2153 B9R2.69 C1CC1CNC2CC2 34a_100000212008_100000742324 [1,0,0,1,0,0|2,0,0]=4 2154 B9R2.69 C1CC1CNC2CC2 34a_100000735609_100000211595 [1,0,0,1,0,0|2,0,0]=4 2155 B9R2.157 C1CN(C1)CC2CC2 269982a_100000754969_100000756562 [1,0,0,1,0,0|2,0,0]=4 2156 B11R2.237 C1CCC(C1)CN2CCC2 269982a_100000754969_100000740388 [0,0,0,1,0,1|2,0,0]=4 2157 B11R2.237 C1CN(C1)CC2=NCCN2 269982a_100000754969_100000737910 [0,0,0,1,0,1|0,0,2]=4 2158 B11R2.237 C1CN(C1)CC2OCCO2 269982a_100000754969_100000755774 [0,0,0,1,0,1|2,0,0]=4 2159 B11R2.237 C1COC(C1)CN2CCC2 269982a_100000754969_100000183445 [0,0,0,1,0,1|2,0,0]=4 2160 B11R2.239 C1CCC(CC1)N2CCC2 269982a_100000754969_100000210327 [0,0,0,1,0,1|2,0,0]=4 2161 B11R2.239 C1COCC(C1)N2CCC2 269982a_100000754969_100000693364 [0,0,0,1,0,1|2,0,0]=4 2162 B11R2.459 O[C@@H]1CCC[C@H]1N2CCC2 269982a_100000754969_200016002552 [0,0,0,1,0,1|2,0,0]=4 2163 B11R2.643 CCCN1CCC12COC2 2230a_100015204706_100000210303 [0,0,0,1,0,1|2,0,0]=4 2164 B11R2.643 CCCN1CCC12COC2 269982a_100015204706_100000210303 [0,0,0,1,0,1|2,0,0]=4 2165 B11R2.643 FCCN1CCC12COC2 2230a_100015204706_100011217306 [0,0,0,1,0,1|2,0,0]=4 2166 B11R2.643 FCCN1CCC12COC2 269982a_100015204706_100011217306 [0,0,0,1,0,1|2,0,0]=4 2167 B11R2.643 OCCN1CCC12COC2 2230a_100015204706_100000211926 [0,0,0,1,0,1|2,0,0]=4 2168 B11R2.643 OCCN1CCC12COC2 269982a_100015204706_100000211926 [0,0,0,1,0,1|2,0,0]=4 2169 B11R2.1039 C(CC1CO1)CN2CCC2 269982a_100000754969_100000733510 [0,0,0,1,0,1|2,0,0]=4 2170 B11R2.157 CCCNC1CC2CC2C1 270004a_100020643023_100010340937 [0,1,0,1,0,0|2,0,0]=4 2171 B11R2.157 OCCNC1CC2CC2C1 270004a_100000210304_100010340937 [0,1,0,1,0,0|2,0,0]=4 2172 B11R2.444 F[C@@H]1C[C@H]1NCCC2CC2 2230a_100025746932_100000694398 [0,1,0,1,0,0|2,0,0]=4 2173 B11R2.444 F[C@@H]1C[C@H]1NCCC2CC2 34a_100025746932_100000694398 [0,1,0,1,0,0|2,0,0]=4 2174 B11R2.444 F[C@H]1C[C@H]1NCCC2CC2 2230a_100015190264_100000694398 [0,1,0,1,0,0|2,0,0]=4 2175 B11R2.891 CCCNC1CC2(C1)CC2 270004a_100020643023_100000718549 [0,1,0,1,0,0|2,0,0]=4 2176 B11R2.891 OCCNC1CC2(C1)CC2 270004a_100000210304_100000718549 [0,1,0,1,0,0|2,0,0]=4 2177 B11R2.1244 CCCN1CCC2(C1)CC2 2230a_100000697357_100000210303 [0,1,0,1,0,0|2,0,0]=4 2178 B11R2.1244 CCCN1CCC2(C1)CC2 269982a_100000697357_100000210303 [0,1,0,1,0,0|2,0,0]=4 2179 B11R2.1244 CCCN1CCC2(C1)CC2 34a_100000697357_100000210303 [0,1,0,1,0,0|2,0,0]=4 2180 B11R2.1244 FCCN1CCC2(C1)CC2 2230a_100000697357_100011217306 [0,1,0,1,0,0|2,0,0]=4 2181 B11R2.1244 FCCN1CCC2(C1)CC2 269982a_100000697357_100011217306 [0,1,0,1,0,0|2,0,0]=4 2182 B11R2.1244 FCCN1CCC2(C1)CC2 34a_100000697357_100011217306 [0,1,0,1,0,0|2,0,0]=4 2183 B11R2.1244 OCCN1CCC2(C1)CC2 2230a_100000697357_100000211926 [0,1,0,1,0,0|2,0,0]=4 2184 B11R2.1244 OCCN1CCC2(C1)CC2 269982a_100000697357_100000211926 [0,1,0,1,0,0|2,0,0]=4 2185 B11R2.1244 OCCN1CCC2(C1)CC2 34a_100000697357_100000211926 [0,1,0,1,0,0|2,0,0]=4 2186 B11R2.1550 CC1(CC1)NCCC2CC2 2230a_100000757604_100000694398 [0,1,0,1,0,0|2,0,0]=4 2187 B11R2.555 CC1CN(C1)CCC2CC2 2230a_100000702820_100000694398 [0,1,0,1,0,0|2,0,0]=4 2188 B11R2.555 CC1CN(C1)CCC2CC2 269982a_100000702820_100000694398 [0,1,0,1,0,0|2,0,0]=4 2189 B11R2.555 CC1CN(C1)CCC2CC2 34a_100000702820_100000694398 [0,1,0,1,0,0|2,0,0]=4 2190 B11R2.555 FC1CN(C1)CCC2CC2 2230a_100000690557_100000694398 [0,1,0,1,0,0|2,0,0]=4 2191 B11R2.555 FC1CN(C1)CCC2CC2 269982a_100000690557_100000694398 [0,1,0,1,0,0|2,0,0]=4 2192 B11R2.555 FC1CN(C1)CCC2CC2 34a_100000690557_100000694398 [0,1,0,1,0,0|2,0,0]=4 2193 B11R2.555 OC1CN(C1)CCC2CC2 269982a_100000749847_100000694398 [0,1,0,1,0,0|2,0,0]=4 2194 B11R2.1034 C(CC1CC1)NCC2CC2 2230a_100000735609_100000694398 [0,1,0,1,0,0|2,0,0]=4 2195 B11R2.1034 C(CC1CC1)NCC2CC2 269862a_100000764129_100000741477 [0,1,0,1,0,0|2,0,0]=4 2196 B11R2.1034 C(CC1CC1)NCC2CC2 34a_100000735609_100000694398 [0,1,0,1,0,0|2,0,0]=4 2197 B11R2.1034 C(CC1CC1)NCC2CC2 34a_100000764129_100000742324 [0,1,0,1,0,0|2,0,0]=4 2198 B11R2.1034 C(CC1CC1)NCC2CO2 34a_100000764129_102125554688 [0,1,0,1,0,0|2,0,0]=4 2199 B11R2.1034 C(COC1CC1)NC2CC2 34a_100000738766_100000211595 [0,1,0,1,0,0|2,0,0]=4 2200 B11R2.115 C[C@@H]1CNC[C@@H]1OC2CC2 34a_200015306588_100000211595 [0,1,0,1,0,0|2,0,0]=4 2201 B11R2.115 N[C@H]1CCC[C@@H]1OC2CC2 34a_100000748460_100000211595 [0,1,0,1,0,0|2,0,0]=4 2202 B11R2.115 N[C@H]1COC[C@@H]1OC2CC2 34a_100015191717_100000211595 [0,1,0,1,0,0|2,0,0]=4 2203 B11R2.385 C1CCN(C1)CCC2CC2 2230a_100000188435_100000694398 [0,1,0,1,0,0|2,0,0]=4 2204 B11R2.385 C1CCN(C1)CCC2CC2 269982a_100000188435_100000694398 [0,1,0,1,0,0|2,0,0]=4 2205 B11R2.385 C1CN(CS1)CCC2CC2 2230a_100011215254_100000694398 [0,1,0,1,0,0|2,0,0]=4 2206 B11R2.385 C1CN(CS1)CCC2CC2 269982a_100011215254_100000694398 [0,1,0,1,0,0|2,0,0]=4 2207 B11R2.385 C1CN[C@H](C1)COC2CC2 34a_100000745186_100000211595 [0,1,0,1,0,0|2,0,0]=4 2208 B11R2.862 CN(CCC1CC1)C2CC2 2230a_100000226674_100000694398 [0,1,0,1,0,0|2,0,0]=4 2209 B11R2.862 CN(CCC1CC1)C2CC2 269982a_100000226674_100000694398 [0,1,0,1,0,0|2,0,0]=4 2210 B11R2.862 OC(CNC1CC1)C2CC2 34a_100000751198_100000211595 [0,1,0,1,0,0|2,0,0]=4 2211 B11R2.362 CC1CCN1CCC2CC2 269982a_100000755817_100000694398 [0,1,0,1,0,0|2,0,0]=4 2212 B11R2.362 CC1CCN1CCC2CC2 34a_100000755817_100000694398 [0,1,0,1,0,0|2,0,0]=4 2213 B11R2.143 CCCN1CCCC12CC2 2230a_100020620911_100000210303 [0,1,0,1,0,0|2,0,0]=4 2214 B11R2.143 CCCN1CCCC12CC2 269982a_100020620911_100000210303 [0,1,0,1,0,0|2,0,0]=4 2215 B11R2.143 CCCN1CCCC12CC2 34a_100020620911_100000210303 [0,1,0,1,0,0|2,0,0]=4 2216 B11R2.143 FCCN1CCCC12CC2 2230a_100020620911_100011217306 [0,1,0,1,0,0|2,0,0]=4 2217 B11R2.143 FCCN1CCCC12CC2 269982a_100020620911_100011217306 [0,1,0,1,0,0|2,0,0]=4 2218 B11R2.143 FCCN1CCCC12CC2 34a_100020620911_100011217306 [0,1,0,1,0,0|2,0,0]=4 2219 B11R2.143 OCCN1CCCC12CC2 2230a_100020620911_100000211926 [0,1,0,1,0,0|2,0,0]=4 2220 B11R2.143 OCCN1CCCC12CC2 269982a_100020620911_100000211926 [0,1,0,1,0,0|2,0,0]=4 2221 B11R2.143 OCCN1CCCC12CC2 34a_100020620911_100000211926 [0,1,0,1,0,0|2,0,0]=4 2222 B11R2.927 CCCNC1CCC2C1C2 269862a_100020643023_100000692480 [0,1,0,1,0,0|2,0,0]=4 2223 B11R2.927 CCCNC1CCC2C1C2 270004a_100020643023_100000692480 [0,1,0,1,0,0|2,0,0]=4 2224 B11R2.927 FCCNC1CCC2C1C2 269862a_100000724931_100000692480 [0,1,0,1,0,0|2,0,0]=4 2225 B11R2.927 OCCNC1CCC2C1C2 269862a_100000210304_100000692480 [0,1,0,1,0,0|2,0,0]=4 2226 B11R2.927 OCCNC1CCC2C1C2 270004a_100000210304_100000692480 [0,1,0,1,0,0|2,0,0]=4 2227 B11R1.4 CCCCCCN1CC=CC1 269982a_100015195280_100000210757 [0,0,0,0,0,2|2,0,0]=4 2228 B11R1.4 CCCCCCN1CCCC1 2230a_100000188435_100000210314 [0,0,0,0,0,2|2,0,0]=4 2229 B11R1.4 CCCCCCN1CCCC1 269982a_100000188435_100000210757 [0,0,0,0,0,2|2,0,0]=4 2230 B11R1.4 CCCCCCN1CCSC1 2230a_100011215254_100000210314 [0,0,0,0,0,2|2,0,0]=4 2231 B11R1.4 CCCCCCN1CCSC1 269982a_100011215254_100000210757 [0,0,0,0,0,2|2,0,0]=4 2232 B11R1.4 CCCNCCC1CCCC1 2230a_100000739158_100000210303 [0,0,0,0,0,2|2,0,0]=4 2233 B11R1.4 CCCNCCC1CCCC1 34a_100000739158_100000210303 [0,0,0,0,0,2|2,0,0]=4 2234 B11R1.4 CCCNCCC1OCCO1 2230a_100000034215_100000210303 [0,0,0,0,0,2|2,0,0]=4 2235 B11R1.4 CCCNCCC1OCCO1 34a_100000034215_100000210303 [0,0,0,0,0,2|2,0,0]=4 2236 B11R1.4 CCCOCCN1CC=CC1 269982a_100015195280_100011215938 [0,0,0,0,0,2|2,0,0]=4 2237 B11R1.4 CCCOCCN1CCCC1 2230a_100000188435_100011215938 [0,0,0,0,0,2|2,0,0]=4 2238 B11R1.4 CCCOCCN1CCCC1 269982a_100000188435_100011215938 [0,0,0,0,0,2|2,0,0]=4 2239 B11R1.4 CCCOCCN1CCSC1 2230a_100011215254_100011215938 [0,0,0,0,0,2|2,0,0]=4 2240 B11R1.4 CCCOCCN1CCSC1 269982a_100011215254_100011215938 [0,0,0,0,0,2|2,0,0]=4 2241 B11R1.4 CCCSCCN1CCCC1 62a_100000210303_100000004467 [0,0,0,0,0,2|2,0,0]=4 2242 B11R1.4 CCCSCCN1CCCC1 62a_100000700749_100000210303 [0,0,0,0,0,2|2,0,0]=4 2243 B11R1.4 FCCCCCN1CC=CC1 269982a_100015195280_100000729378 [0,0,0,0,0,2|2,0,0]=4 2244 B11R1.4 FCCCCCN1CCCC1 2230a_100000188435_100000729378 [0,0,0,0,0,2|2,0,0]=4 2245 B11R1.4 FCCCCCN1CCCC1 269982a_100000188435_100000729378 [0,0,0,0,0,2|2,0,0]=4 2246 B11R1.4 FCCCCCN1CCSC1 2230a_100011215254_100000729378 [0,0,0,0,0,2|2,0,0]=4 2247 B11R1.4 FCCCCCN1CCSC1 269982a_100011215254_100000729378 [0,0,0,0,0,2|2,0,0]=4 2248 B11R1.4 FCCNCCC1CCCC1 2230a_100000739158_100011217306 [0,0,0,0,0,2|2,0,0]=4 2249 B11R1.4 FCCNCCC1CCCC1 34a_100000724931_100000760354 [0,0,0,0,0,2|2,0,0]=4 2250 B11R1.4 FCCNCCC1CCCC1 34a_100000739158_100011217306 [0,0,0,0,0,2|2,0,0]=4 2251 B11R1.4 FCCNCCC1OCCO1 2230a_100000034215_100011217306 [0,0,0,0,0,2|2,0,0]=4 2252 B11R1.4 FCCNCCC1OCCO1 34a_100000034215_100011217306 [0,0,0,0,0,2|2,0,0]=4 2253 B11R1.4 FCCNCCC1OCCO1 34a_100000724931_100000740749 [0,0,0,0,0,2|2,0,0]=4 2254 B11R1.4 FCCSCCN1CCCC1 62a_100000700749_100011217306 [0,0,0,0,0,2|2,0,0]=4 2255 B11R1.4 FCCSCCN1CCCC1 62a_100011217306_100000004467 [0,0,0,0,0,2|2,0,0]=4 2256 B11R1.4 NCCOCCC1CCCC1 34a_100000210304_100000760354 [0,0,0,0,0,2|2,0,0]=4 2257 B11R1.4 NCCOCCC1OCCO1 34a_100000210304_100000740749 [0,0,0,0,0,2|2,0,0]=4 2258 B11R1.4 OCCCCCN1CC=CC1 269982a_100015195280_100000746330 [0,0,0,0,0,2|2,0,0]=4 2259 B11R1.4 OCCCCCN1CCCC1 2230a_100000188435_100000746330 [0,0,0,0,0,2|2,0,0]=4 2260 B11R1.4 OCCCCCN1CCCC1 269982a_100000188435_100000746330 [0,0,0,0,0,2|2,0,0]=4 2261 B11R1.4 OCCCCCN1CCSC1 2230a_100011215254_100000746330 [0,0,0,0,0,2|2,0,0]=4 2262 B11R1.4 OCCCCCN1CCSC1 269982a_100011215254_100000746330 [0,0,0,0,0,2|2,0,0]=4 2263 B11R1.4 OCCNCCC1CCCC1 2230a_100000739158_100000211926 [0,0,0,0,0,2|2,0,0]=4 2264 B11R1.4 OCCNCCC1CCCC1 2230a_100016997473_100000760354 [0,0,0,0,0,2|2,0,0]=4 2265 B11R1.4 OCCNCCC1CCCC1 34a_100000739158_100000211926 [0,0,0,0,0,2|2,0,0]=4 2266 B11R1.4 OCCNCCC1CCCC1 34a_100016990907_100000760354 [0,0,0,0,0,2|2,0,0]=4 2267 B11R1.4 OCCNCCC1OCCO1 2230a_100000034215_100000211926 [0,0,0,0,0,2|2,0,0]=4 2268 B11R1.4 OCCNCCC1OCCO1 2230a_100016997473_100000740749 [0,0,0,0,0,2|2,0,0]=4 2269 B11R1.4 OCCNCCC1OCCO1 34a_100000034215_100000211926 [0,0,0,0,0,2|2,0,0]=4 2270 B11R1.4 OCCNCCC1OCCO1 34a_100016990907_100000740749 [0,0,0,0,0,2|2,0,0]=4 2271 B11R1.4 OCCOCCN1CC=CC1 269982a_100015195280_100011215305 [0,0,0,0,0,2|2,0,0]=4 2272 B11R1.4 OCCOCCN1CCCC1 2230a_100000188435_100011215305 [0,0,0,0,0,2|2,0,0]=4 2273 B11R1.4 OCCOCCN1CCCC1 269982a_100000188435_100011215305 [0,0,0,0,0,2|2,0,0]=4 2274 B11R1.4 OCCOCCN1CCSC1 2230a_100011215254_100011215305 [0,0,0,0,0,2|2,0,0]=4 2275 B11R1.4 OCCOCCN1CCSC1 269982a_100011215254_100011215305 [0,0,0,0,0,2|2,0,0]=4 2276 B11R1.4 OCCSCCN1CCCC1 62a_100000211926_100000004467 [0,0,0,0,0,2|2,0,0]=4 2277 B11R1.4 OCCSCCN1CCCC1 62a_100000700749_100000211926 [0,0,0,0,0,2|2,0,0]=4